OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
1F88
1F88_refined
2.8
A
Inactive
22
97
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Palczewski K, Kumasaka T, Hori T, Behnke CA, Motoshima H, Fox BA, Le Trong I, Teller DC, Okada T, Stenkamp RE, Yamamoto M, Miyano M
10.1126/SCIENCE.289.5480.739
2000-08-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
1HZX
-
2.8
A
Inactive
22
98
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Teller DC, Okada T, Behnke CA, Palczewski K, Stenkamp RE
10.1021/BI0155091
2001-07-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
1L9H
-
2.6
A
Inactive
22
98
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Okada T, Fujiyoshi Y, Silow M, Navarro J, Landau EM, Shichida Y
10.1073/PNAS.082666399
2002-05-15
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
1GZM
1GZM_refined
2.7
A
Inactive
22
94
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
-
10.1016/J.JMB.2004.08.090
2003-11-20
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
1U19
1U19_refined
2.2
A
Inactive
22
100
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Okada T, Sugihara M, Bondar AN, Elstner M, Entel P, Buss V
10.1016/J.JMB.2004.07.044
2004-10-12
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2HPY
-
2.8
B
Inactive
22
100
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Nakamichi H, Okada T
10.1073/PNAS.0601765103
2006-08-22
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2G87
-
2.6
A
Inactive
22
100
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Nakamichi H, Okada T
10.1002/ANIE.200600595
2006-09-02
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2I35
-
3.8
A
Inactive
22
94
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K
10.1073/PNAS.0608022103
2006-10-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2I36
-
4.1
A
Inactive
22
94
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K
10.1073/PNAS.0608022103
2006-10-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2I37
-
4.2
A
Inactive
22
91
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K
10.1073/PNAS.0608022103
2006-10-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2J4Y
-
3.4
B
Inactive
22
94
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Standfuss J, Xie G, Edwards PC, Burghammer M, Oprian DD, Schertler GF
10.1016/J.JMB.2007.03.007
2007-09-25
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2PED
-
3.0
B
Inactive
22
100
-
-
-
-
-
-
Retinal (9-cis)
small-molecule
Inverse agonist
-
-
No
No
Nakamichi H, Buss V, Okada T
10.1529/BIOPHYSJ.107.108225
2007-10-30
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
2RH1
-
2.4
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Cherezov V, Rosenbaum DM, Hanson MA, Rasmussen SG, Thian FS, Kobilka TS, Choi HJ, Kuhn P, Weis WI, Kobilka BK, Stevens RC
10.1126/SCIENCE.1150577
2007-10-30
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
2R4R
-
3.4
A
Inactive
1
52
-
-
-
-
-
Antibody
-
-
-
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Rasmussen SG, Choi HJ, Rosenbaum DM, Kobilka TS, Thian FS, Edwards PC, Burghammer M, Ratnala VR, Sanishvili R, Fischetti RF, Schertler GF, Weis WI, Kobilka BK
10.1038/NATURE06325
2007-11-06
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
2R4S
-
3.4
A
Inactive
1
52
-
-
-
-
-
Antibody
-
-
-
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Rasmussen SG, Choi HJ, Rosenbaum DM, Kobilka TS, Thian FS, Edwards PC, Burghammer M, Ratnala VR, Sanishvili R, Fischetti RF, Schertler GF, Weis WI, Kobilka BK
10.1038/NATURE06325
2007-11-06
Yes
OPSD
Rhodopsin
Opsins
A
Japanese flying squid
X-ray
2ZIY
-
3.7
A
Inactive
16
83
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
Yes
No
Shimamura T, Hiraki K, Takahashi N, Hori T, Ago H, Masuda K, Takio K, Ishiguro M, Miyano M
10.1074/JBC.C800040200
2008-05-06
Yes
OPSD
Rhodopsin
Opsins
A
Japanese flying squid
X-ray
2Z73
2Z73_refined
2.5
A
Inactive
16
78
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
Yes
No
Murakami M, Kouyama T
10.1038/NATURE06925
2008-05-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3D4S
3D4S_refined
2.8
A
Inactive
0
67
-
-
-
-
T4-Lysozyme
-
timolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Hanson MA, Cherezov V, Griffith MT, Roth CB, Jaakola VP, Chien EY, Velasquez J, Kuhn P, Stevens RC
10.1016/J.STR.2008.05.001
2008-06-17
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2VT4
-
2.7
B
Inactive
0
57
-
-
-
-
-
-
(S)-Cyanopindolol
small-molecule
Antagonist
-
-
Yes
No
Warne T, Serrano-Vega MJ, Baker JG, Moukhametzianov R, Edwards PC, Henderson R, Leslie AG, Tate CG, Schertler GF
10.1038/NATURE07101
2008-06-24
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3CAP
-
2.9
A
Active
97
94
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Park JH, Scheerer P, Hofmann KP, Choe HW, Ernst OP
10.1038/NATURE07063
2008-06-24
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3C9L
3C9L_refined
2.7
A
Inactive
22
94
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Stenkamp RE
10.1107/S0907444908017162
2008-08-05
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3C9M
-
3.4
A
Inactive
22
94
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Stenkamp RE
10.1107/S0907444908017162
2008-08-05
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3DQB
3DQB_refined
3.2
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Scheerer P, Park JH, Hildebrand PW, Kim YJ, Krauss N, Choe HW, Hofmann KP, Ernst OP
10.1038/NATURE07330
2008-09-23
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3EML
-
2.6
A
Inactive
1
70
-
-
-
-
T4-Lysozyme
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Jaakola VP, Griffith MT, Hanson MA, Cherezov V, Chien EY, Lane JR, Ijzerman AP, Stevens RC
10.1126/SCIENCE.1164772
2008-10-14
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3KJ6
-
3.4
A
Inactive
1
54
-
-
-
-
-
Antibody
-
-
-
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Bokoch MP, Zou Y, Rasmussen SG, Liu CW, Nygaard R, Rosenbaum DM, Fung JJ, Choi HJ, Thian FS, Kobilka TS, Puglisi JD, Weis WI, Pardo L, Prosser RS, Mueller L, Kobilka BK
10.1038/NATURE08650
2010-02-16
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3NY8
3NY8_refined
2.8
A
Inactive
0
67
-
-
-
-
T4-Lysozyme
-
CHEMBL1233766
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC
10.1021/JA105108Q
2010-08-11
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3NY9
3NY9_refined
2.8
A
Inactive
0
67
-
-
-
-
T4-Lysozyme
-
CHEMBL1233771
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC
10.1021/JA105108Q
2010-08-11
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3NYA
3NYA_refined
3.2
A
Inactive
0
67
-
-
-
-
T4-Lysozyme
-
CHEMBL1160734
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC
10.1021/JA105108Q
2010-08-11
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
3ODU
3ODU_refined
2.5
A
Inactive
3
83
-
-
-
-
T4-Lysozyme
-
isothiourea-1t
small-molecule
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC
10.1126/SCIENCE.1194396
2010-10-27
Yes
DRD3
D3
Dopamine
A
Human
X-ray
3PBL
3PBL_refined
2.9
A
Inactive
1
68
-
-
-
-
T4-Lysozyme
-
eticlopride
small-molecule
Antagonist
dopamine
small-molecule
Yes
No
Chien EY, Liu W, Zhao Q, Katritch V, Han GW, Hanson MA, Shi L, Newman AH, Javitch JA, Cherezov V, Stevens RC
10.1126/SCIENCE.1197410
2010-11-03
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3PDS
3PDS_refined
3.5
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
FAUC50
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Rosenbaum DM, Zhang C, Lyons JA, Holl R, Aragao D, Arlow DH, Rasmussen SG, Choi HJ, Devree BT, Sunahara RK, Chae PS, Gellman SH, Dror RO, Shaw DE, Weis WI, Caffrey M, Gmeiner P, Kobilka BK
10.1038/NATURE09665
2011-01-12
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3PXO
-
3.0
A
Active
97
94
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Choe HW, Kim YJ, Park JH, Morizumi T, Pai EF, Krauss N, Hofmann KP, Scheerer P, Ernst OP
10.1038/NATURE09789
2011-03-09
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
2X72
2X72_refined
3.0
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Standfuss J, Edwards PC, D'Antona A, Fransen M, Xie G, Oprian DD, Schertler GF
10.1038/NATURE09795
2011-03-16
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
2YDV
2YDV_refined
2.6
A
Active
74
75
-
-
-
-
-
-
NECA
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Lebon G, Warne T, Edwards PC, Bennett K, Langmead CJ, Leslie AG, Tate CG
10.1038/NATURE10136
2011-05-18
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2YCY
-
3.2
A
Inactive
0
60
-
-
-
-
-
-
(S)-Cyanopindolol
small-molecule
Antagonist
-
-
Yes
No
Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF
10.1073/PNAS.1100185108
2011-06-08
Yes
OPSD
Rhodopsin
Opsins
A
Japanese flying squid
X-ray
3AYN
-
2.7
B
Inactive
16
77
-
-
-
-
-
-
Retinal (9-cis)
small-molecule
Inverse agonist
-
-
Yes
No
Murakami M, Kouyama T
10.1016/J.JMB.2011.08.044
2011-08-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3RFM
3RFM_refined
3.6
A
Inactive
1
71
-
-
-
-
-
-
caffeine
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Dore AS, Robertson N, Errey JC, Ng I, Hollenstein K, Tehan B, Hurrell E, Bennett K, Congreve M, Magnani F, Tate CG, Weir M, Marshall FH
10.1016/J.STR.2011.06.014
2011-09-07
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3VGA
-
3.1
A
Inactive
1
72
-
-
-
-
-
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Hino T, Arakawa T, Iwanari H, Yurugi-Kobayashi T, Ikeda-Suno C, Nakada-Nakura Y, Kusano-Arai O, Weyand S, Shimamura T, Nomura N, Cameron AD, Kobayashi T, Hamakubo T, Iwata S, Murata T
10.1038/NATURE10750
2012-02-01
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3UZA
3UZA_refined
3.3
A
Inactive
1
71
-
-
-
-
-
-
compound 4g [PMID: 22220592]
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Congreve M, Andrews SP, Doré AS, Hollenstein K, Hurrell E, Langmead CJ, Mason JS, Ng IW, Tehan B, Zhukov A, Weir M, Marshall FH.
10.1021/jm201376w
2012-03-21
Yes
OPRM
μ
Opioid
A
Mouse
X-ray
4DKL
4DKL_refined
2.8
A
Inactive
3
71
-
-
-
-
T4-Lysozyme
-
Methyl 4-[[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]amino]-4-oxobutanoate
small-molecule
Antagonist
-
-
Yes
No
Manglik A, Kruse AC, Kobilka TS, Thian FS, Mathiesen JM, Sunahara RK, Pardo L, Weis WI, Kobilka BK, Granier S
10.1038/NATURE10954
2012-03-21
Yes
OPRD
δ
Opioid
A
Mouse
X-ray
4EJ4
4EJ4_refined
3.4
A
Inactive
3
76
-
-
-
-
T4-Lysozyme
-
naltrindole
small-molecule
Antagonist
α-neoendorphin, [Leu]enkephalin, [Met]enkephalin
peptide
Yes
No
Granier S, Manglik A, Kruse AC, Kobilka TS, Thian FS, Weis WI, Kobilka BK
10.1038/NATURE11111
2012-05-16
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4GRV
4GRV_refined
2.8
A
Active
92
69
-
-
-
-
T4-Lysozyme
-
JMV431
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
White JF, Noinaj N, Shibata Y, Love J, Kloss B, Xu F, Gvozdenovic-Jeremic J, Shah P, Shiloach J, Tate CG, Grisshammer R
10.1038/NATURE11558
2012-10-17
Yes
5HT1B
5-HT1B
5-Hydroxytryptamine
A
Human
X-ray
4IAQ
4IAQ_refined
2.8
A
Inactive
14
70
-
-
-
-
BRIL
-
dihydroergotamine
small-molecule
Agonist
tryptamine, 5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
Wang C, Jiang Y, Ma J, Wu H, Wacker D, Katritch V, Han GW, Liu W, Huang XP, Vardy E, McCorvy JD, Gao X, Zhou XE, Melcher K, Zhang C, Bai F, Yang H, Yang L, Jiang H, Roth BL, Cherezov V, Stevens RC, Xu HE
10.1126/SCIENCE.1232807
2013-03-13
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
3ZPR
3ZPR_refined
2.7
B
Inactive
0
61
-
-
-
-
-
-
CHEMBL1559535
small-molecule
Antagonist
-
-
Yes
Yes
Christopher JA, Brown J, Doré AS, Errey JC, Koglin M, Marshall FH, Myszka DG, Rich RL, Tate CG, Tehan B, Warne T, Congreve M.
10.1021/jm400140q
2013-04-03
Yes
GLR
glucagon
Glucagon
B1
Human
X-ray
4L6R
4L6R_refined
3.3
A
Inactive
5
61
-
-
-
-
BRIL
-
-
-
-
glucagon
peptide
No
No
Siu FY, He M, de Graaf C, Han GW, Yang D, Zhang Z, Zhou C, Xu Q, Wacker D, Joseph JS, Liu W, Lau J, Cherezov V, Katritch V, Wang MW, Stevens RC
10.1038/nature12393
2013-07-24
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
4LDE
4LDE_refined
2.8
A
Active
100
69
-
-
-
-
T4-Lysozyme
Nanobody
CHEMBL1615159
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ring AM, Manglik A, Kruse AC, Enos MD, Weis WI, Garcia KC, Kobilka BK
10.1038/NATURE12572
2013-09-25
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
4MQS
4MQS_refined
3.5
A
Active
99
59
-
-
-
-
-
Nanobody
iperoxo
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Kruse AC, Ring AM, Manglik A, Hu J, Hu K, Eitel K, Hubner H, Pardon E, Valant C, Sexton PM, Christopoulos A, Felder CC, Gmeiner P, Steyaert J, Weis WI, Garcia KC, Wess J, Kobilka BK
10.1038/NATURE12735
2013-11-27
Yes
SMO
SMO
Frizzled
F
Human
X-ray
4N4W
4N4W_refined
2.8
A
Inactive
0
44
-
-
-
-
BRIL
-
SANT-1
small-molecule
Antagonist
-
-
No
No
Wang C, Wu H, Evron T, Vardy E, Han GW, Huang XP, Hufeisen SJ, Mangano TJ, Urban DJ, Katritch V, Cherezov V, Caron MG, Roth BL, Stevens RC
10.1038/NCOMMS5355
2014-01-22
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4BWB
-
3.6
A
Inactive
2
72
-
-
-
-
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A
10.1073/PNAS.1317903111
2014-01-29
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
4BVN
4BVN_refined
2.1
A
Inactive
0
60
-
-
-
-
-
-
(S)-Cyanopindolol
small-molecule
Antagonist
-
-
Yes
Yes
Miller-Gallacher JL, Nehme R, Warne T, Edwards PC, Schertler GF, Leslie AG, Tate CG
10.1371/JOURNAL.PONE.0092727
2014-04-02
Yes
P2Y12
P2Y12
P2Y
A
Human
X-ray
4PY0
4PY0_refined
3.1
A
Intermediate
42
83
-
-
-
-
BRIL
-
2MeSATP
small-molecule
Agonist (partial)
ATP, ADP
small-molecule
Yes
No
Zhang J, Zhang K, Gao ZG, Paoletta S, Zhang D, Han GW, Li T, Ma L, Zhang W, Muller CE, Yang H, Jiang H, Cherezov V, Katritch V, Jacobson KA, Stevens RC, Wu B, Zhao Q
10.1038/NATURE13288
2014-04-30
Yes
SMO
SMO
Frizzled
F
Human
X-ray
4QIN
4QIN_refined
2.6
A
Inactive
11
43
-
-
-
-
BRIL
-
SAG1.5
small-molecule
Agonist
-
-
No
No
Wang C, Wu H, Evron T, Vardy E, Han GW, Huang XP, Hufeisen SJ, Mangano TJ, Urban DJ, Katritch V, Cherezov V, Caron MG, Roth BL, Stevens RC
10.1038/NCOMMS5355
2014-07-23
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Rat
X-ray
4U16
4U16_refined
3.7
B
Inactive
3
47
-
-
-
-
T4-Lysozyme
-
N-methyl scopolamine
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Thorsen TS, Matt R, Weis WI, Kobilka BK
10.1016/J.STR.2014.08.022
2014-11-26
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
4RWS
4RWS_refined
3.1
A
Inactive
3
78
-
-
-
-
T4-Lysozyme
-
viral macrophage inflammatory protein-II
peptide
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Qin L, Kufareva I, Holden LG, Wang C, Zheng Y, Zhao C, Fenalti G, Wu H, Han GW, Cherezov V, Abagyan R, Stevens RC, Handel TM
10.1126/SCIENCE.1261064
2015-02-11
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
X-ray
4Z34
4Z34_refined
3.0
A
Inactive
1
80
-
-
-
-
BRIL
-
ONO-9780307
small-molecule
Antagonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Chrencik JE, Roth CB, Terakado M, Kurata H, Omi R, Kihara Y, Warshaviak D, Nakade S, Asmar-Rovira G, Mileni M, Mizuno H, Griffith MT, Rodgers C, Han GW, Velasquez J, Chun J, Stevens RC, Hanson MA
10.1016/J.CELL.2015.06.002
2015-06-03
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4XEE
4XEE_refined
2.9
A
Active
92
71
-
-
-
-
T4-Lysozyme
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Krumm BE, White JF, Shah P, Grisshammer R
10.1038/NCOMMS8895
2015-07-29
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
5CGC
5CGC_refined
3.1
A
Inactive
-
20
-
-
-
-
T4-Lysozyme
-
CHEMBL3603915
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Christopher JA, Aves SJ, Bennett KA, Doré AS, Errey JC, Jazayeri A, Marshall FH, Okrasa K, Serrano-Vega MJ, Tehan BG, Wiggin GR, Congreve M.
10.1021/acs.jmedchem.5b00892
2015-08-12
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
4ZUD
4ZUD_refined
2.8
A
Inactive
3
75
-
-
-
-
BRIL
-
OLMESARTAN
small-molecule
Inverse agonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Zhang H, Unal H, Desnoyer R, Han GW, Patel N, Katritch V, Karnik SS, Cherezov V, Stevens RC
10.1074/JBC.M115.689000
2015-10-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4X1H
4X1H_refined
2.3
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
B-Nonylglucoside
small-molecule
unknown
-
-
No
No
Blankenship E, Vahedi-Faridi A, Lodowski DT
10.1016/J.STR.2015.09.015
2015-11-04
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
5D5B
5D5B_refined
3.8
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Huang CY, Olieric V, Ma P, Howe N, Vogeley L, Liu X, Warshamanage R, Weinert T, Panepucci E, Kobilka B, Diederichs K, Wang M, Caffrey M
10.1107/S2059798315021683
2016-01-13
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
X-ray
5DSG
5DSG_refined
2.6
B
Inactive
3
60
-
-
-
-
T4-Lysozyme
-
tiotropium
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Thal DM, Sun B, Feng D, Nawaratne V, Leach K, Felder CC, Bures MG, Evans DA, Weis WI, Bachhawat P, Kobilka TS, Sexton PM, Kobilka BK, Christopoulos A
10.1038/NATURE17188
2016-03-16
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5IU4
5IU4_refined
1.7
A
Inactive
1
71
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM.
10.1021/acs.jmedchem.6b00653
2016-06-29
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5IU7
5IU7_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
2-(Furan-2-yl)-5-N-[2-(4-phenylpiperidin-1-yl)ethyl]-1H-[1,2,4]triazolo[1,5-a][1,3,5]triazin-8-ium-5,7-diamine
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM.
10.1021/acs.jmedchem.6b00653
2016-06-29
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5IUB
5IUB_refined
2.1
A
Inactive
1
71
-
-
-
-
BRIL
-
CHEMBL184061
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM.
10.1021/acs.jmedchem.6b00653
2016-06-29
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5G53
5G53_refined
3.4
A
Active
100
68
Gs
αs
Engineered G protein
50
-
-
NECA
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Carpenter B, Nehme R, Warne T, Leslie AG, Tate CG
10.1038/NATURE18966
2016-08-03
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
5GLI
5GLI_refined
2.5
A
Inactive
5
71
-
-
-
-
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Nishizawa T, Okuta A, Tani K, Dohmae N, Fujiyoshi Y, Nureki O, Doi T
10.1038/nature19319
2016-09-07
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5K2C
5K2C_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V
10.1126/SCIADV.1600292
2016-09-21
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
5U09
5U09_refined
2.6
A
Inactive
9
60
-
-
-
-
Glycogen synthase
-
taranabant
small-molecule
Inverse agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Shao Z, Yin J, Chapman K, Grzemska M, Clark L, Wang J, Rosenbaum DM
10.1038/NATURE20613
2016-12-07
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5UIG
5UIG_refined
3.5
A
Inactive
19
70
-
-
-
-
BRIL
-
5-Amino-N-[(2-Methoxyphenyl)methyl]-2-(3-Methylphenyl)-2h-1,2,3-Triazole-4-Carboximidamide
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Sun B, Bachhawat P, Chu ML, Wood M, Ceska T, Sands ZA, Mercier J, Lebon F, Kobilka TS, Kobilka BK
10.1073/PNAS.1621423114
2017-02-08
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
5UNF
5UNF_refined
2.8
A
Active
99
79
-
-
-
-
BRIL
-
compound 1 [PMID: 28379944]
small-molecule
Antagonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K, Tolstikova A, White TA, Hunter MS, Weierstall U, Liu W, Babaoglu K, Moore EL, Katz RD, Shipman JM, Garcia-Calvo M, Sharma S, Sheth P, Soisson SM, Stevens RC, Katritch V, Cherezov V
10.1038/NATURE22035
2017-04-05
Yes
PAR2
PAR2
Proteinase-activated
A
Human
X-ray
5NDZ
5NDZ_refined
3.6
A
Intermediate
42
74
-
-
-
-
BRIL
-
AZ3451
small-molecule
Allosteric antagonist
-
-
Yes
Yes
Cheng RKY, Fiez-Vandal C, Schlenker O, Edman K, Aggeler B, Brown DG, Brown GA, Cooke RM, Dumelin CE, Dore AS, Geschwindner S, Grebner C, Hermansson NO, Jazayeri A, Johansson P, Leong L, Prihandoko R, Rappas M, Soutter H, Snijder A, Sundstrom L, Tehan B, Thornton P, Troast D, Wiggin G, Zhukov A, Marshall FH, Dekker N
10.1038/NATURE22309
2017-05-03
Yes
SMO
SMO
Frizzled
F
Human
X-ray
5V56
5V56_refined
2.9
B
Inactive
1
61
-
-
-
-
Flavodoxin
-
N-methyl-N-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-4-nitro-2-(trifluoromethyl)benzamide
small-molecule
Antagonist
-
-
No
No
Zhang X, Zhao F, Wu Y, Yang J, Han GW, Zhao S, Ishchenko A, Ye L, Lin X, Ding K, Dharmarajan V, Griffin PR, Gati C, Nelson G, Hunter MS, Hanson MA, Cherezov V, Stevens RC, Tan W, Tao H, Xu F
10.1038/NCOMMS15383
2017-05-24
Yes
GLR
glucagon
Glucagon
B1
Human
X-ray
5XEZ
5XEZ_refined
3.0
B
Inactive
0
82
-
-
-
-
T4-Lysozyme
Antibody
NNC0640
small-molecule
NAM
glucagon
peptide
No
No
Zhang H, Qiao A, Yang D, Yang L, Dai A, de Graaf C, Reedtz-Runge S, Dharmarajan V, Zhang H, Han GW, Grant TD, Sierra RG, Weierstall U, Nelson G, Liu W, Wu Y, Ma L, Cai X, Lin G, Wu X, Geng Z, Dong Y, Song G, Griffin PR, Lau J, Cherezov V, Yang H, Hanson MA, Stevens RC, Zhao Q, Jiang H, Wang MW, Wu B
10.1038/NATURE22363
2017-05-24
Yes
FFAR1
FFA1
Free fatty acid
A
Human
X-ray
5TZR
5TZR_refined
2.2
A
Intermediate
42
91
-
-
-
-
T4-Lysozyme
-
MK-8666
small-molecule
Agonist
docosahexaenoic acid, oleic acid, α-linolenic acid, myristic acid
small-molecule
No
No
Lu J, Byrne N, Wang J, Bricogne G, Brown FK, Chobanian HR, Colletti SL, Di Salvo J, Thomas-Fowlkes B, Guo Y, Hall DL, Hadix J, Hastings NB, Hermes JD, Ho T, Howard AD, Josien H, Kornienko M, Lumb KJ, Miller MW, Patel SB, Pio B, Plummer CW, Sherborne BS, Sheth P, Souza S, Tummala S, Vonrhein C, Webb M, Allen SJ, Johnston JM, Weinglass AB, Sharma S, Soisson SM
10.1038/NSMB.3417
2017-06-07
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
5XR8
5XR8_refined
3.0
A
Active
96
60
-
-
-
-
Flavodoxin
-
AM841
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Vemuri K, Nikas SP, Laprairie RB, Wu Y, Qu L, Pu M, Korde A, Jiang S, Ho JH, Han GW, Ding K, Li X, Liu H, Hanson MA, Zhao S, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ
10.1038/NATURE23272
2017-07-12
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5MZP
5MZP_refined
2.1
A
Inactive
1
71
-
-
-
-
BRIL
-
caffeine
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM
10.1016/j.str.2017.06.012
2017-07-26
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
5TUD
5TUD_refined
3.0
D
Active
87
58
-
-
-
-
BRIL
Antibody
ergotamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Ishchenko A, Wacker D, Kapoor M, Zhang A, Han GW, Basu S, Patel N, Messerschmidt M, Weierstall U, Liu W, Katritch V, Roth BL, Stevens RC, Cherezov V
10.1073/PNAS.1700891114
2017-07-26
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
5XPR
5XPR_refined
3.6
A
Inactive
5
69
-
-
-
-
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Nishizawa T, Yamashita K, Inoue A, Hirata K, Kadji FMN, Okuta A, Tani K, Aoki J, Fujiyoshi Y, Doi T, Nureki O
10.1038/NSMB.3450
2017-08-16
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5NM4
-
1.7
A
Inactive
1
73
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Weinert T, Olieric N, Cheng R, Brunle S, James D, Ozerov D, Gashi D, Vera L, Marsh M, Jaeger K, Dworkowski F, Panepucci E, Basu S, Skopintsev P, Dore AS, Geng T, Cooke RM, Liang M, Prota AE, Panneels V, Nogly P, Ermler U, Schertler G, Hennig M, Steinmetz MO, Wang M, Standfuss J
10.1038/S41467-017-00630-4
2017-09-27
Yes
OX2R
OX2
Orexin
A
Human
X-ray
5WQC
5WQC_refined
2.0
A
Inactive
1
68
-
-
-
-
Glycogen synthase
-
EMPA
small-molecule
Antagonist
orexin-A, orexin-B
peptide
Yes
No
Suno R, Kimura KT, Nakane T, Yamashita K, Wang J, Fujiwara T, Yamanaka Y, Im D, Horita S, Tsujimoto H, Tawaramoto MS, Hirokawa T, Nango E, Tono K, Kameshima T, Hatsui T, Joti Y, Yabashi M, Shimamoto K, Yamamoto M, Rosenbaum DM, Iwata S, Shimamura T, Kobayashi T
10.1016/J.STR.2017.11.005
2017-11-29
Yes
Q9WTK1
BLT1
Leukotriene
A
Guinea pig
X-ray
5X33
5X33_refined
3.7
A
Inactive
3
78
-
-
-
-
T4-Lysozyme
-
BIIL 260
small-molecule
Antagonist
-
-
Yes
No
Hori T, Okuno T, Hirata K, Yamashita K, Kawano Y, Yamamoto M, Hato M, Nakamura M, Shimizu T, Yokomizo T, Miyano M, Yokoyama S
10.1038/NCHEMBIO.2547
2018-01-03
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OLH
5OLH_refined
2.6
A
Inactive
1
72
-
-
-
-
BRIL
-
vipadenant
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OM1
5OM1_refined
2.1
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL2024114
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
5HT1B
5-HT1B
5-Hydroxytryptamine
A
Human
X-ray
5V54
5V54_refined
3.9
A
Inactive
14
71
-
-
-
-
BRIL
-
CHEMBL428892
small-molecule
Antagonist
tryptamine, 5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2018-02-07
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5WF6
5WF6_refined
2.9
A
Active
74
68
-
-
-
-
T4-Lysozyme
-
UK-432,097
small-molecule
Agonist
adenosine
small-molecule
No
No
-
-
2018-02-21
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
6FFI
6FFI_refined
2.2
A
Inactive
-
20
-
-
-
-
T4-Lysozyme
-
methoxy-MPEP
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Christopher JA, Orgovan Z, Congreve M, Dore AS, Errey JC, Marshall FH, Mason JS, Okrasa K, Rucktooa P, Serrano-Vega MJ, Ferenczy GG, Keseru GM
10.1021/ACS.JMEDCHEM.7B01722
2018-03-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FK7
6FK7_refined
2.6
A
Active
97
94
-
-
-
-
-
-
(2~{S})-2-(4-chlorophenyl)-3-methyl-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FKA
6FKA_refined
2.7
A
Active
97
94
-
-
-
-
-
-
(2~{S})-2-(3,4-dichlorophenyl)-3-methyl-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
NPY1R
Y1
Neuropeptide Y
A
Human
X-ray
5ZBH
5ZBH_refined
3.0
A
Inactive
1
78
-
-
-
-
T4-Lysozyme
-
BMS-193885
small-molecule
Antagonist
pancreatic polypeptide, neuropeptide Y, peptide YY
peptide
Yes
No
Yang Z, Han S, Keller M, Kaiser A, Bender BJ, Bosse M, Burkert K, Kogler LM, Wifling D, Bernhardt G, Plank N, Littmann T, Schmidt P, Yi C, Li B, Ye S, Zhang R, Xu B, Larhammar D, Stevens RC, Huster D, Meiler J, Zhao Q, Beck-Sickinger AG, Buschauer A, Wu B
10.1038/S41586-018-0046-X
2018-04-25
Yes
Q98SW5
SMO
Frizzled
F
African clawed frog
X-ray
6D32
6D32_refined
3.8
A
Active
78
58
-
-
-
-
BRIL
-
cyclopamine
small-molecule
Agonist (partial)
-
-
No
No
Huang P, Zheng S, Wierbowski BM, Kim Y, Nedelcu D, Aravena L, Liu J, Kruse AC, Salic A
10.1016/J.CELL.2018.04.029
2018-05-23
Yes
Q80KM9
US28
Unclassified
A
strain AD169
X-ray
5WB1
5WB1_refined
3.5
A
Active
99
82
-
-
-
-
-
Nanobody
-
-
-
-
-
Yes
No
Miles TF, Spiess K, Jude KM, Tsutsumi N, Burg JS, Ingram JR, Waghray D, Hjorto GM, Larsen O, Ploegh HL, Rosenkilde MM, Garcia KC
10.7554/ELIFE.35850
2018-06-13
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
6DDE
6DDE_refined
3.5
R
Active
100
71
Gi/o
αi1
-
61
-
Antibody
DAMGO
peptide
Agonist
-
-
Yes
No
Koehl A, Hu H, Maeda S, Zhang Y, Qu Q, Paggi JM, Latorraca NR, Hilger D, Dawson R, Matile H, Schertler GFX, Granier S, Weis WI, Dror RO, Manglik A, Skiniotis G, Kobilka BK
10.1038/S41586-018-0219-7
2018-06-13
Yes
AA1R
A1
Adenosine
A
Human
cryo-EM
6D9H
6D9H_refined
3.6
R
Active
100
88
Gi/o
αi2
-
59
-
-
adenosine
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Draper-Joyce CJ, Khoshouei M, Thal DM, Liang YL, Nguyen ATN, Furness SGB, Venugopal H, Baltos JA, Plitzko JM, Danev R, Baumeister W, May LT, Wootten D, Sexton PM, Glukhova A, Christopoulos A
10.1038/S41586-018-0236-6
2018-06-20
Yes
FZD4
FZD4
Frizzled
F
Human
X-ray
6BD4
6BD4_refined
2.4
A
Inactive
22
61
-
-
-
-
Rubredoxin
-
-
-
-
-
-
No
No
Yang S, Wu Y, Xu TH, de Waal PW, He Y, Pu M, Chen Y, DeBruine ZJ, Zhang B, Zaidi SA, Popov P, Guo Y, Han GW, Lu Y, Suino-Powell K, Dong S, Harikumar KG, Miller LJ, Katritch V, Xu HE, Shui W, Stevens RC, Melcher K, Zhao S, Xu F
10.1038/S41586-018-0447-X
2018-08-22
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
6DS0
6DS0_refined
3.2
A
Intermediate
42
59
-
-
-
-
BRIL
-
LY266097
small-molecule
Antagonist
5-hydroxytryptamine
small-molecule
Yes
No
McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL
10.1038/s41594-018-0116-7
2018-08-29
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FUF
6FUF_refined
3.1
A
Active
100
91
Gi/o
αo
Mini-Go
51
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Tsai CJ, Pamula F, Nehme R, Muhle J, Weinert T, Flock T, Nogly P, Edwards PC, Carpenter B, Gruhl T, Ma P, Deupi X, Standfuss J, Tate CG, Schertler GFX
10.1126/SCIADV.AAT7052
2018-10-03
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6H7M
6H7M_refined
2.8
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb6B9
levosalbutamol
small-molecule
Agonist
-
-
Yes
No
Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG
10.1126/SCIENCE.AAU5595
2018-10-17
Yes
CCR5
CCR5
Chemokine
A
Human
X-ray
6AKX
6AKX_refined
2.8
B
Inactive
16
82
-
-
-
-
Rubredoxin
-
N-[(1S)-3-{(3-exo)-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl}-1-(thiophen-2-yl)propyl]cyclopentanecarboxamide
small-molecule
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Peng P, Chen H, Zhu Y, Wang Z, Li J, Luo RH, Wang J, Chen L, Yang LM, Jiang H, Xie X, Wu B, Zheng YT, Liu H.
10.1021/acs.jmedchem.8b01077
2018-10-24
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
5ZK3
5ZK3_refined
2.6
A
Inactive
3
59
-
-
-
-
BRIL
-
CHEMBL558910
small-molecule
Antagonist
acetylcholine
small-molecule
No
No
Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T
10.1038/S41589-018-0152-Y
2018-11-21
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
X-ray
6FJ3
-
2.5
A
Inactive
0
62
-
-
-
-
GlgA glycogen synthase
-
ePTH
peptide
Agonist (partial)
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Ehrenmann J, Schoppe J, Klenk C, Rappas M, Kummer L, Dore AS, Pluckthun A
10.1038/S41594-018-0151-4
2018-11-21
Yes
PE2R3
EP3
Prostanoid
A
Human
X-ray
6M9T
6M9T_refined
2.5
A
Active
92
70
-
-
-
-
T4-Lysozyme
-
Misoprostol-FA
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Audet M, White KL, Breton B, Zarzycka B, Han GW, Lu Y, Gati C, Batyuk A, Popov P, Velasquez J, Manahan D, Hu H, Weierstall U, Liu W, Shui W, Katritch V, Cherezov V, Hanson MA, Stevens RC
10.1038/S41589-018-0160-Y
2018-12-05
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
6MET
6MET_refined
4.5
B
Inactive
16
89
-
-
-
-
-
T-cell surface glycoprotein CD4
Envelope glycoprotein gp160
protein
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Shaik MM, Peng H, Lu J, Rits-Volloch S, Xu C, Liao M, Chen B
10.1038/S41586-018-0804-9
2018-12-12
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
X-ray
6WJC
-
2.6
A
Inactive
3
62
-
-
-
-
T4-Lysozyme
-
ENDO-ATROPINE
muscarinic toxin 7
small-molecule peptide
Antagonist NAM
acetylcholine
small-molecule
No
No
Maeda S, Xu J, N Kadji FM, Clark MJ, Zhao J, Tsutsumi N, Aoki J, Sunahara RK, Inoue A, Garcia KC, Kobilka BK
10.1126/SCIENCE.AAX2517
2020-07-08
Yes
ADRB2
β2
Adrenoceptors
A
Human
cryo-EM
7BZ2
7BZ2_refined
3.8
R
Active
100
69
Gs
αs
-
50
-
Nanobody-35
arformoterol
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Zhang Y, Yang F, Ling S, Lv P, Zhou Y, Fang W, Sun W, Zhang L, Shi P, Tian C
10.1038/S41421-020-0176-9
2020-08-05
Yes
GLR
glucagon
Glucagon
B1
Human
cryo-EM
6WPW
6WPW_refined
3.1
R
Active
100
83
Gs
αs
-
56
-
Nanobody-35
Glucagon derivative ZP3780
peptide
Agonist
glucagon
peptide
No
No
Hilger D, Kumar KK, Hu H, Pedersen MF, O'Brien ES, Giehm L, Jennings C, Eskici G, Inoue A, Lerch M, Mathiesen JM, Skiniotis G, Kobilka BK
10.1126/SCIENCE.ABA3373
2020-08-12
Yes
VIPR1
VPAC1
VIP and PACAP
B1
Human
cryo-EM
6VN7
6VN7_refined
3.2
R
Active
100
58
Gs
αs
-
61
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, secretin, GHRH, PACAP-38, VIP, PHI
peptide
No
No
Duan J, Shen DD, Zhou XE, Bi P, Liu QF, Tan YX, Zhuang YW, Zhang HB, Xu PY, Huang SJ, Ma SS, He XH, Melcher K, Zhang Y, Xu HE, Jiang Y
10.1038/S41467-020-17933-8
2020-09-02
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6X18
6X18_refined
2.1
R
Active
100
83
Gs
αs
-
90
-
Nanobody-35
CHEMBL410972
protein
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Singh N, Singh D, Bhide A, Sharma R, Bhowmick S, Patel V, Modi D
10.1101/2020.08.16.252585
2020-09-09
Yes
SUCR1
succinate
Succinate
A
Rat
X-ray
6Z10
6Z10_refined
2.3
A
Intermediate
42
90
-
-
-
-
-
Nanobody-6
CHEMBL4751488
small-molecule
Antagonist
-
-
Yes
No
Velcicky J,Wilcken R,Cotesta S,Janser P,Schlapbach A,Wagner T,Piechon P,Villard F,Bouhelal R,Piller F,Harlfinger S,Stringer R,Fehlmann D,Kaupmann K,Littlewood-Evans A,Haffke M,Gommermann N
10.1021/acs.jmedchem.0c01020
2020-09-16
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
6WGT
6WGT_refined
3.4
B
Inactive
1
59
-
-
-
-
BRIL
-
Lysergide
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
Yes
No
Kim K, Che T, Panova O, DiBerto JF, Lyu J, Krumm BE, Wacker D, Robertson MJ, Seven AB, Nichols DE, Shoichet BK, Skiniotis G, Roth BL
10.1016/J.CELL.2020.08.024
2020-09-23
Yes
SMO
SMO
Frizzled
F
Human
cryo-EM
6XBJ
6XBJ_refined
3.9
R
Active
100
59
Gi/o
αi1
-
61
-
scFv16
Cholesterol
small-molecule
Agonist
-
-
No
No
Qi X, Friedberg L, De Bose-Boyd R, Long T, Li X
10.1038/S41589-020-0646-2
2020-09-30
Yes
SMO
SMO
Frizzled
F
Human
cryo-EM
6XBM
6XBM_refined
3.2
R
Active
100
42
Gi/o
αi1
-
61
-
scFv16
24,25-Epoxy-cholesterol
24,25-Epoxy-cholesterol
small-molecule small-molecule
Agonist PAM
-
-
No
No
Qi X, Friedberg L, De Bose-Boyd R, Long T, Li X
10.1038/S41589-020-0646-2
2020-09-30
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
3OE0
-
2.9
A
Inactive
3
78
-
-
-
-
T4-Lysozyme
-
CVX15
peptide
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC
10.1126/SCIENCE.1194396
2010-10-27
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2Y00
2Y00_refined
2.5
B
Inactive
0
62
-
-
-
-
-
-
Dobutamine
small-molecule
Agonist (partial)
-
-
Yes
No
Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG
10.1038/NATURE09746
2011-01-12
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2Y02
2Y02_refined
2.6
B
Inactive
0
62
-
-
-
-
-
-
CARMOTEROL
small-molecule
Agonist
-
-
Yes
No
Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG
10.1038/NATURE09746
2011-01-12
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3OAX
-
2.6
A
Inactive
22
100
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
No
No
Makino CL, Riley CK, Looney J, Crouch RK, Okada T
10.1016/J.BPJ.2010.08.003
2011-01-19
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2Y01
-
2.6
A
Inactive
0
59
-
-
-
-
-
-
Dobutamine
small-molecule
Agonist (partial)
-
-
Yes
No
Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG
10.1038/NATURE09746
2011-03-30
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2YCW
2YCW_refined
3.0
A
Inactive
0
61
-
-
-
-
-
-
Carazolol
small-molecule
Antagonist
-
-
Yes
No
-
-
2011-06-01
Yes
OPSD
Rhodopsin
Opsins
A
Japanese flying squid
X-ray
3AYM
-
2.8
B
Inactive
16
77
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
Yes
No
Murakami M, Kouyama T
10.1016/J.JMB.2011.08.044
2011-08-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3REY
3REY_refined
3.3
A
Inactive
1
71
-
-
-
-
-
-
xanthine amine congener
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Dore AS, Robertson N, Errey JC, Ng I, Hollenstein K, Tehan B, Hurrell E, Bennett K, Congreve M, Magnani F, Tate CG, Weir M, Marshall FH
10.1016/J.STR.2011.06.014
2011-09-07
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
3UON
3UON_refined
3.0
A
Inactive
3
60
-
-
-
-
T4-Lysozyme
-
CHEMBL558910
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Haga K, Kruse AC, Asada H, Yurugi-Kobayashi T, Shiroishi M, Zhang C, Weis WI, Okada T, Kobilka BK, Haga T, Kobayashi T
10.1038/NATURE10753
2012-02-01
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
X-ray
3V2Y
3V2Y_refined
2.8
A
Inactive
1
76
-
-
-
-
T4-Lysozyme
-
W146
small-molecule
Antagonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Hanson MA, Roth CB, Jo E, Griffith MT, Scott FL, Reinhart G, Desale H, Clemons B, Cahalan SM, Schuerer SC, Sanna MG, Han GW, Kuhn P, Rosen H, Stevens RC
10.1126/SCIENCE.1215904
2012-02-15
Yes
OPRK
κ
Opioid
A
Human
X-ray
4DJH
4DJH_refined
2.9
A
Inactive
3
76
-
-
-
-
T4-Lysozyme
-
JDTic
small-molecule
Antagonist
big dynorphin, β-neoendorphin, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Wu H, Wacker D, Mileni M, Katritch V, Han GW, Vardy E, Liu W, Thompson AA, Huang XP, Carroll FI, Mascarella SW, Westkaemper RB, Mosier PD, Roth BL, Cherezov V, Stevens RC
10.1038/NATURE10939
2012-03-21
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
4AMJ
4AMJ_refined
2.3
B
Inactive
0
62
-
-
-
-
-
-
CHEMBL3799125
small-molecule
Inverse agonist
-
-
Yes
No
Warne T, Edwards PC, Leslie AG, Tate CG
10.1016/J.STR.2012.03.014
2012-05-23
Yes
PAR1
PAR1
Proteinase-activated
A
Human
X-ray
3VW7
3VW7_refined
2.2
A
Intermediate
42
66
-
-
-
-
T4-Lysozyme
-
vorapaxar
small-molecule
Antagonist
thrombin
peptide
Yes
No
Zhang C, Srinivasan Y, Arlow DH, Fung JJ, Palmer D, Zheng Y, Green HF, Pandey A, Dror RO, Shaw DE, Weis WI, Coughlin SR, Kobilka BK
10.1038/NATURE11701
2012-12-12
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
3ZPQ
3ZPQ_refined
2.8
B
Inactive
0
62
-
-
-
-
-
-
CHEMBL200234
small-molecule
Antagonist
-
-
Yes
Yes
Christopher JA, Brown J, Doré AS, Errey JC, Koglin M, Marshall FH, Myszka DG, Rich RL, Tate CG, Tehan B, Warne T, Congreve M.
10.1021/jm400140q
2013-04-03
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4BEY
4BEY_refined
2.9
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Singhal A, Ostermaier MK, Vishnivetskiy SA, Panneels V, Homan KT, Tesmer JJ, Veprintsev D, Deupi X, Gurevich VV, Schertler GF, Standfuss J
10.1038/EMBOR.2013.44
2013-05-08
Yes
CCR5
CCR5
Chemokine
A
Human
X-ray
4MBS
4MBS_refined
2.7
A
Inactive
16
83
-
-
-
-
Rubredoxin
-
maraviroc
small-molecule
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Tan Q, Zhu Y, Li J, Chen Z, Han GW, Kufareva I, Li T, Ma L, Fenalti G, Li J, Zhang W, Xie X, Yang H, Jiang H, Cherezov V, Liu H, Stevens RC, Zhao Q, Wu B
10.1126/SCIENCE.1241475
2013-09-11
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
4LDO
4LDO_refined
3.2
A
Active
100
69
-
-
-
-
T4-Lysozyme
Nanobody
(-)-adrenaline
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ring AM, Manglik A, Kruse AC, Enos MD, Weis WI, Garcia KC, Kobilka BK
10.1038/NATURE12572
2013-09-25
Yes
OPRD
δ
Opioid
A
Human
X-ray
4N6H
4N6H_refined
1.8
A
Inactive
3
81
-
-
-
-
BRIL
-
naltrindole
small-molecule
Antagonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
Yes
Fenalti G, Giguere PM, Katritch V, Huang XP, Thompson AA, Cherezov V, Roth BL, Stevens RC
10.1038/NATURE12944
2013-12-25
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4BV0
-
3.1
A
Inactive
2
70
-
-
-
-
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A
10.1073/PNAS.1317903111
2014-01-29
Yes
P2Y12
P2Y12
P2Y
A
Human
X-ray
4NTJ
4NTJ_refined
2.6
A
Intermediate
42
78
-
-
-
-
BRIL
-
AZD1283
small-molecule
Antagonist
ATP, ADP
small-molecule
Yes
No
Zhang K, Zhang J, Gao ZG, Zhang D, Zhu L, Han GW, Moss SM, Paoletta S, Kiselev E, Lu W, Fenalti G, Zhang W, Muller CE, Yang H, Jiang H, Cherezov V, Katritch V, Jacobson KA, Stevens RC, Wu B, Zhao Q
10.1038/NATURE13083
2014-03-26
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
4OO9
4OO9_refined
2.6
A
Inactive
-
20
-
-
-
-
T4-Lysozyme
-
MAVOGLURANT
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Dore AS, Okrasa K, Patel JC, Serrano-Vega M, Bennett K, Cooke RM, Errey JC, Jazayeri A, Khan S, Tehan B, Weir M, Wiggin GR, Marshall FH
10.1038/NATURE13396
2014-07-02
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
4QKX
4QKX_refined
3.3
A
Active
100
69
-
-
-
-
T4-Lysozyme
Nanobody
Q27453560
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Weichert D, Kruse AC, Manglik A, Hiller C, Zhang C, Hubner H, Kobilka BK, Gmeiner P
10.1073/PNAS.1410415111
2014-07-23
Yes
OPRD
δ
Opioid
A
Human
X-ray
4RWA
4RWA_refined
3.3
A
Inactive
3
77
-
-
-
-
BRIL
-
DIPP-NH2
peptide
Antagonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Fenalti G, Zatsepin NA, Betti C, Giguere P, Han GW, Ishchenko A, Liu W, Guillemyn K, Zhang H, James D, Wang D, Weierstall U, Spence JC, Boutet S, Messerschmidt M, Williams GJ, Gati C, Yefanov OM, White TA, Oberthuer D, Metz M, Yoon CH, Barty A, Chapman HN, Basu S, Coe J, Conrad CE, Fromme R, Fromme P, Tourwe D, Schiller PW, Roth BL, Ballet S, Katritch V, Stevens RC, Cherezov V
10.1038/NSMB.2965
2015-01-14
Yes
US28
US28
Unclassified
A
strain AD169
X-ray
4XT1
-
2.9
A
Active
99
82
-
-
-
-
-
Nanobody
CX3 CL1
peptide
Agonist (partial)
-
-
Yes
No
Burg JS, Ingram JR, Venkatakrishnan AJ, Jude KM, Dukkipati A, Feinberg EN, Angelini A, Waghray D, Dror RO, Ploegh HL, Garcia KC
10.1126/SCIENCE.AAA5026
2015-03-04
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
4UG2
4UG2_refined
2.6
A
Active
74
71
-
-
-
-
-
-
CGS 21680
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Lebon G, Edwards PC, Leslie AG, Tate CG
10.1124/mol.114.097360
2015-04-08
Yes
OPSD
Rhodopsin
Opsins
A
Japanese flying squid
X-ray
4WW3
4WW3_refined
2.8
A
Inactive
16
78
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
Yes
No
Murakami M, Kouyama T
10.1371/JOURNAL.PONE.0126970
2015-06-17
Yes
OPRM
μ
Opioid
A
Mouse
X-ray
5C1M
5C1M_refined
2.1
A
Active
100
74
-
-
-
-
-
Antibody
BU72
small-molecule
Agonist
-
-
Yes
No
Huang W, Manglik A, Venkatakrishnan AJ, Laeremans T, Feinberg EN, Sanborn AL, Kato HE, Livingston KE, Thorsen TS, Kling RC, Granier S, Gmeiner P, Husbands SM, Traynor JR, Weis WI, Steyaert J, Dror RO, Kobilka BK
10.1038/NATURE14886
2015-08-05
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
5A8E
5A8E_refined
2.4
A
Inactive
0
59
-
-
-
-
-
-
7-methylcyanopindolol
small-molecule
Inverse agonist
-
-
Yes
Yes
Sato T, Baker J, Warne T, Brown GA, Leslie AG, Congreve M, Tate CG
10.1124/MOL.115.101030
2015-09-30
Yes
OPRX
NOP
Opioid
A
Human
X-ray
5DHG
5DHG_refined
3.0
A
Inactive
3
76
-
-
-
-
BRIL
-
CHEMBL1783826
small-molecule
Antagonist
nociceptin/orphanin FQ
peptide
Yes
No
Miller RL, Thompson AA, Trapella C, Guerrini R, Malfacini D, Patel N, Han GW, Cherezov V, Calo G, Katritch V, Stevens RC
10.1016/J.STR.2015.07.024
2015-10-21
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
5F8U
5F8U_refined
3.4
A
Inactive
0
57
-
-
-
-
-
-
(S)-Cyanopindolol
small-molecule
Antagonist
-
-
Yes
No
Leslie AG, Warne T, Tate CG
10.1038/NSMB.3130
2015-12-23
Yes
OX1R
OX1
Orexin
A
Human
X-ray
4ZJC
4ZJC_refined
2.8
A
Inactive
1
72
-
-
-
-
GlgA glycogen synthase
-
SB-674042
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Yin J, Babaoglu K, Brautigam CA, Clark L, Shao Z, Scheuermann TH, Harrell CM, Gotter AL, Roecker AJ, Winrow CJ, Renger JJ, Coleman PJ, Rosenbaum DM
10.1038/NSMB.3183
2016-03-09
Yes
GLR
glucagon
Glucagon
B1
Human
X-ray
5EE7
5EE7_refined
2.5
A
Inactive
0
54
-
-
-
-
T4-Lysozyme
-
Octaethylene glycol monoethyl ether
MK-0893
small-molecule small-molecule
Antagonist NAM
glucagon
peptide
No
No
Jazayeri A, Dore AS, Lamb D, Krishnamurthy H, Southall SM, Baig AH, Bortolato A, Koglin M, Robertson NJ, Errey JC, Andrews SP, Teobald I, Brown AJ, Cooke RM, Weir M, Marshall FH
10.1038/NATURE17414
2016-04-20
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5IU8
5IU8_refined
2.0
A
Inactive
1
71
-
-
-
-
BRIL
-
CHEMBL3934661
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM.
10.1021/acs.jmedchem.6b00653
2016-06-29
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
5JQH
5JQH_refined
3.2
A
Inactive
0
70
-
-
-
-
T4-Lysozyme
Nanobody
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Staus DP, Strachan RT, Manglik A, Pani B, Kahsai AW, Kim TH, Wingler LM, Ahn S, Chatterjee A, Masoudi A, Kruse AC, Pardon E, Steyaert J, Weis WI, Prosser RS, Kobilka BK, Costa T, Lefkowitz RJ
10.1038/NATURE18636
2016-07-13
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
5DYS
5DYS_refined
2.3
A
Active
97
94
-
-
-
-
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Singhal A, Guo Y, Matkovic M, Schertler G, Deupi X, Yan EC, Standfuss J
10.15252/EMBR.201642671
2016-08-10
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
5D6L
5D6L_refined
3.2
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ma P, Weichert D, Aleksandrov LA, Jensen TJ, Riordan JR, Liu X, Kobilka BK, Caffrey M
10.1038/NPROT.2017.057
2016-08-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5K2B
5K2B_refined
2.5
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V
10.1126/SCIADV.1600292
2016-09-21
Yes
CCR9
CCR9
Chemokine
A
Human
X-ray
5LWE
-
2.8
B
Inactive
52
67
-
-
-
-
-
-
vercirnon
small-molecule
Allosteric antagonist
CCL25
peptide
No
No
Oswald C, Rappas M, Kean J, Dore AS, Errey JC, Bennett K, Deflorian F, Christopher JA, Jazayeri A, Mason JS, Congreve M, Cooke RM, Marshall FH
10.1038/NATURE20606
2016-12-07
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
5TVN
5TVN_refined
2.9
A
Intermediate
42
61
-
-
-
-
BRIL
-
Lysergide
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Wacker D, Wang S, McCorvy JD, Betz RM, Venkatakrishnan AJ, Levit A, Lansu K, Schools ZL, Che T, Nichols DE, Shoichet BK, Dror RO, Roth BL
10.1016/J.CELL.2016.12.033
2017-02-01
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
5TE5
5TE5_refined
4.0
A
Inactive
22
100
-
-
-
-
-
-
10,20-Methanoretinal
small-molecule
Agonist
-
-
No
No
Gulati S, Jastrzebska B, Banerjee S, Placeres AL, Miszta P, Gao S, Gunderson K, Tochtrop GP, Filipek S, Katayama K, Kiser PD, Mogi M, Stewart PL, Palczewski K
10.1073/PNAS.1617446114
2017-03-15
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
5UNG
5UNG_refined
2.8
B
Active
99
83
-
-
-
-
BRIL
-
compound 1 [PMID: 28379944]
small-molecule
Antagonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K, Tolstikova A, White TA, Hunter MS, Weierstall U, Liu W, Babaoglu K, Moore EL, Katz RD, Shipman JM, Garcia-Calvo M, Sharma S, Sheth P, Soisson SM, Stevens RC, Katritch V, Cherezov V
10.1038/NATURE22035
2017-04-05
Yes
PAR2
PAR2
Proteinase-activated
A
Human
X-ray
5NJ6
5NJ6_refined
4.0
A
Intermediate
42
74
-
-
-
-
BRIL
Fab3949
-
-
-
-
-
Yes
No
Cheng RKY, Fiez-Vandal C, Schlenker O, Edman K, Aggeler B, Brown DG, Brown GA, Cooke RM, Dumelin CE, Dore AS, Geschwindner S, Grebner C, Hermansson NO, Jazayeri A, Johansson P, Leong L, Prihandoko R, Rappas M, Soutter H, Snijder A, Sundstrom L, Tehan B, Thornton P, Troast D, Wiggin G, Zhukov A, Marshall FH, Dekker N
10.1038/NATURE22309
2017-05-03
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5UVI
5UVI_refined
3.2
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Martin-Garcia JM, Conrad CE, Nelson G, Stander N, Zatsepin NA, Zook J, Zhu L, Geiger J, Chun E, Kissick D, Hilgart MC, Ogata C, Ishchenko A, Nagaratnam N, Roy-Chowdhury S, Coe J, Subramanian G, Schaffer A, James D, Ketwala G, Venugopalan N, Xu S, Corcoran S, Ferguson D, Weierstall U, Spence JCH, Cherezov V, Fromme P, Fischetti RF, Liu W
10.1107/S205225251700570X
2017-05-24
Yes
SMO
SMO
Frizzled
F
Human
X-ray
5V57
5V57_refined
3.0
A
Inactive
1
62
-
-
-
-
Flavodoxin
-
N-methyl-N-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-4-nitro-2-(trifluoromethyl)benzamide
small-molecule
Antagonist
-
-
No
No
Zhang X, Zhao F, Wu Y, Yang J, Han GW, Zhao S, Ishchenko A, Ye L, Lin X, Ding K, Dharmarajan V, Griffin PR, Gati C, Nelson G, Hunter MS, Hanson MA, Cherezov V, Stevens RC, Tan W, Tao H, Xu F
10.1038/NCOMMS15383
2017-05-24
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5JTB
5JTB_refined
2.8
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Melnikov I, Polovinkin V, Kovalev K, Gushchin I, Shevtsov M, Shevchenko V, Mishin A, Alekseev A, Rodriguez-Valera F, Borshchevskiy V, Cherezov V, Leonard GA, Gordeliy V, Popov A
10.1126/SCIADV.1602952
2017-05-31
Yes
APJ
apelin
Apelin
A
Human
X-ray
5VBL
-
2.6
B
Inactive
3
79
-
-
-
-
Rubredoxin
-
AMG3054
peptide
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Ma Y, Yue Y, Ma Y, Zhang Q, Zhou Q, Song Y, Shen Y, Li X, Ma X, Li C, Hanson MA, Han GW, Sickmier EA, Swaminath G, Zhao S, Stevens RC, Hu LA, Zhong W, Zhang M, Xu F
10.1016/J.STR.2017.04.008
2017-05-31
Yes
CCR5
CCR5
Chemokine
A
Human
X-ray
5UIW
-
2.2
A
Inactive
16
85
-
-
-
-
Rubredoxin
-
5P7-CCL5
protein
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Zheng Y, Han GW, Abagyan R, Wu B, Stevens RC, Cherezov V, Kufareva I, Handel TM
10.1016/J.IMMUNI.2017.05.002
2017-06-28
Yes
OPSD
Rhodopsin
Opsins
A
Human
X-ray
5W0P
5W0P_refined
3.0
D
Active
100
93
Visual
S-arrestin
-
90
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhou XE, He Y, de Waal PW, Gao X, Kang Y, Van Eps N, Yin Y, Pal K, Goswami D, White TA, Barty A, Latorraca NR, Chapman HN, Hubbell WL, Dror RO, Stevens RC, Cherezov V, Gurevich VV, Griffin PR, Ernst OP, Melcher K, Xu HE
10.1016/J.CELL.2017.07.002
2017-08-09
Yes
DRD4
D4
Dopamine
A
Human
X-ray
5WIV
-
2.1
A
Inactive
1
58
-
-
-
-
BRIL
-
[3H]NEMONAPRIDE
small-molecule
Antagonist
dopamine
small-molecule
Yes
Yes
Wang S, Wacker D, Levit A, Che T, Betz RM, McCorvy JD, Venkatakrishnan AJ, Huang XP, Dror RO, Shoichet BK, Roth BL
10.1126/SCIENCE.AAN5468
2017-10-18
Yes
OX2R
OX2
Orexin
A
Human
X-ray
5WS3
5WS3_refined
2.3
A
Inactive
1
70
-
-
-
-
Glycogen synthase
-
EMPA
small-molecule
Antagonist
orexin-A, orexin-B
peptide
Yes
No
Suno R, Kimura KT, Nakane T, Yamashita K, Wang J, Fujiwara T, Yamanaka Y, Im D, Horita S, Tsujimoto H, Tawaramoto MS, Hirokawa T, Nango E, Tono K, Kameshima T, Hatsui T, Joti Y, Yabashi M, Shimamoto K, Yamamoto M, Rosenbaum DM, Iwata S, Shimamura T, Kobayashi T
10.1016/J.STR.2017.11.005
2017-12-13
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6AQF
6AQF_refined
2.5
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Eddy MT, Lee MY, Gao ZG, White KL, Didenko T, Horst R, Audet M, Stanczak P, McClary KM, Han GW, Jacobson KA, Stevens RC, Wuthrich K
10.1016/J.CELL.2017.12.004
2018-01-10
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OLO
5OLO_refined
3.1
A
Inactive
1
72
-
-
-
-
BRIL
-
tozadenant
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OM4
5OM4_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL2024114
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
X-ray
6BQG
6BQG_refined
3.0
A
Active
87
62
-
-
-
-
BRIL
-
ergotamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Peng Y, McCorvy JD, Harpsoe K, Lansu K, Yuan S, Popov P, Qu L, Pu M, Che T, Nikolajsen LF, Huang XP, Wu Y, Shen L, Bjorn-Yoshimoto WE, Ding K, Wacker D, Han GW, Cheng J, Katritch V, Jensen AA, Hanson MA, Zhao S, Gloriam DE, Roth BL, Stevens RC, Liu ZJ
10.1016/j.cell.2018.01.001
2018-02-14
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5WF5
5WF5_refined
2.6
A
Active
74
69
-
-
-
-
T4-Lysozyme
-
UK-432,097
small-molecule
Agonist
adenosine
small-molecule
No
No
White KL, Eddy MT, Gao ZG, Han GW, Lian T, Deary A, Patel N, Jacobson KA, Katritch V, Stevens RC
10.1016/J.STR.2017.12.013
2018-02-21
Yes
DRD2
D2
Dopamine
A
Human
X-ray
6CM4
6CM4_refined
2.9
A
Inactive
1
59
-
-
-
-
T4-Lysozyme
-
risperidone
small-molecule
Inverse agonist
dopamine
small-molecule
Yes
No
Wang S, Che T, Levit A, Shoichet BK, Wacker D, Roth BL
10.1038/NATURE25758
2018-03-14
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FK8
6FK8_refined
2.9
A
Active
97
94
-
-
-
-
-
-
(2~{R},3~{S})-3-azanyl-2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FKB
6FKB_refined
3.0
A
Active
97
94
-
-
-
-
-
-
2-(4-Chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
NPY1R
Y1
Neuropeptide Y
A
Human
X-ray
5ZBQ
5ZBQ_refined
2.7
A
Inactive
1
80
-
-
-
-
T4-Lysozyme
-
CHEMBL3747822
small-molecule
Antagonist
pancreatic polypeptide, neuropeptide Y, peptide YY
peptide
Yes
No
Yang Z, Han S, Keller M, Kaiser A, Bender BJ, Bosse M, Burkert K, Kogler LM, Wifling D, Bernhardt G, Plank N, Littmann T, Schmidt P, Yi C, Li B, Ye S, Zhang R, Xu B, Larhammar D, Stevens RC, Huster D, Meiler J, Zhao Q, Beck-Sickinger AG, Buschauer A, Wu B
10.1038/S41586-018-0046-X
2018-04-25
Yes
Q98SW5
SMO
Frizzled
F
African clawed frog
X-ray
6D35
6D35_refined
3.9
A
Active
78
58
-
-
-
-
BRIL
-
Cholesterol
small-molecule
Agonist
-
-
No
No
Huang P, Zheng S, Wierbowski BM, Kim Y, Nedelcu D, Aravena L, Liu J, Kruse AC, Salic A
10.1016/J.CELL.2018.04.029
2018-05-23
Yes
C5AR1
C5a1
Complement peptide
A
Human
X-ray
6C1R
6C1R_refined
2.2
B
Inactive
6
83
-
-
-
-
BRIL
-
PMX53
avacopan
peptide small-molecule
Antagonist NAM
C3a, C5a, C5a des-Arg, ribosomal protein S19
peptide
Yes
No
Liu H, Kim HR, Deepak RNVK, Wang L, Chung KY, Fan H, Wei Z, Zhang C
10.1038/S41594-018-0067-Z
2018-05-30
Yes
PTAFR
PAF
Platelet-activating factor
A
Human
X-ray
5ZKP
5ZKP_refined
2.8
A
Other
-
85
-
-
-
-
Flavodoxin
-
foropafant
small-molecule
Antagonist
methylcarbamyl PAF, PAF
small-molecule
Yes
No
Cao C, Tan Q, Xu C, He L, Yang L, Zhou Y, Zhou Y, Qiao A, Lu M, Yi C, Han GW, Wang X, Li X, Yang H, Rao Z, Jiang H, Zhao Y, Liu J, Stevens RC, Zhao Q, Zhang XC, Wu B
10.1038/S41594-018-0068-Y
2018-06-20
Yes
PTAFR
PAF
Platelet-activating factor
A
Human
X-ray
5ZKQ
5ZKQ_refined
2.9
B
Intermediate
42
83
-
-
-
-
T4-Lysozyme
-
ABT-491
small-molecule
Inverse agonist
methylcarbamyl PAF, PAF
small-molecule
Yes
No
Cao C, Tan Q, Xu C, He L, Yang L, Zhou Y, Zhou Y, Qiao A, Lu M, Yi C, Han GW, Wang X, Li X, Yang H, Rao Z, Jiang H, Zhao Y, Liu J, Stevens RC, Zhao Q, Zhang XC, Wu B
10.1038/S41594-018-0068-Y
2018-06-20
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
5XJM
5XJM_refined
3.2
A
Active
100
78
-
-
-
-
BRIL
Fab
CHEMBL404594
protein
Agonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Asada H, Horita S, Hirata K, Shiroishi M, Shiimura Y, Iwanari H, Hamakubo T, Shimamura T, Nomura N, Kusano-Arai O, Uemura T, Suno C, Kobayashi T, Iwata S
10.1038/S41594-018-0079-8
2018-07-11
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
6DRX
6DRX_refined
3.1
A
Intermediate
42
59
-
-
-
-
BRIL
-
lisuride
small-molecule
Antagonist
5-hydroxytryptamine
small-molecule
Yes
No
McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL
10.1038/s41594-018-0116-7
2018-08-29
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
6E3Y
6E3Y_refined
3.3
R
Active
100
75
Gs
αs
-
48
-
Nanobody-35 RAMP1
Calcitonin gene-related peptide 1
peptide
Agonist
-
-
No
No
Liang YL, Khoshouei M, Deganutti G, Glukhova A, Koole C, Peat TS, Radjainia M, Plitzko JM, Baumeister W, Miller LJ, Hay DL, Christopoulos A, Reynolds CA, Wootten D, Sexton PM
10.1038/S41586-018-0535-Y
2018-09-19
Yes
CCR5
CCR5
Chemokine
A
Human
X-ray
6AKY
6AKY_refined
2.8
A
Inactive
16
81
-
-
-
-
Rubredoxin
-
CCR5 antagonist 34
small-molecule
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Peng P, Chen H, Zhu Y, Wang Z, Li J, Luo RH, Wang J, Chen L, Yang LM, Jiang H, Xie X, Wu B, Zheng YT, Liu H.
10.1021/acs.jmedchem.8b01077
2018-10-24
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
5ZK8
5ZK8_refined
3.0
A
Inactive
3
59
-
-
-
-
BRIL
-
N-methyl scopolamine
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T
10.1038/S41589-018-0152-Y
2018-11-21
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
6IGK
6IGK_refined
2.0
A
Inactive
5
70
-
-
-
-
T4-Lysozyme
-
endothelin-3
peptide
Agonist
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Izume T, Inoue A, Yamashita K, Kadji FMN, Hirata K, Aoki J, Nishizawa T, Nureki O
10.1038/S41467-018-07094-0
2018-11-21
Yes
PE2R4
EP4
Prostanoid
A
Human
X-ray
5YWY
5YWY_refined
3.2
A
Inactive
11
57
-
-
-
-
-
Fab
ONO-AE3-208
small-molecule
Antagonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
No
No
Toyoda Y, Morimoto K, Suno R, Horita S, Yamashita K, Hirata K, Sekiguchi Y, Yasuda S, Shiroishi M, Shimizu T, Urushibata Y, Kajiwara Y, Inazumi T, Hotta Y, Asada H, Nakane T, Shiimura Y, Nakagita T, Tsuge K, Yoshida S, Kuribara T, Hosoya T, Sugimoto Y, Nomura N, Sato M, Hirokawa T, Kinoshita M, Murata T, Takayama K, Yamamoto M, Narumiya S, Iwata S, Kobayashi T
10.1038/S41589-018-0131-3
2018-12-05
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
6MEO
6MEO_refined
3.9
B
Inactive
16
89
-
-
-
-
-
T-cell surface glycoprotein CD4
Envelope glycoprotein gp160
protein
Antagonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Shaik MM, Peng H, Lu J, Rits-Volloch S, Xu C, Liao M, Chen B
10.1038/S41586-018-0804-9
2018-12-12
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7C7Q
-
3.0
B
Active
-
71
-
-
-
-
-
-
(-)-baclofen
BHFF
small-molecule small-molecule
Agonist PAM
-
-
No
No
Mao C, Shen C, Li C, Shen DD, Xu C, Zhang S, Zhou R, Shen Q, Chen LN, Jiang Z, Liu J, Zhang Y
10.1038/S41422-020-0350-5
2020-07-01
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6S0Q
6S0Q_refined
2.7
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
-
-
2020-07-15
Yes
5HT1B
5-HT1B
5-Hydroxytryptamine
A
Human
X-ray
7C61
7C61_refined
3.0
A
Inactive
14
68
-
-
-
-
BRIL
IgG heavy chain IgG light chain
ergotamine
small-molecule
Antagonist
tryptamine, 5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
Miyagi H, Asada H, Suzuki M, Takahashi Y, Yasunaga M, Suno C, Iwata S, Saito JI
10.1038/S41598-020-68355-X
2020-07-29
Yes
OXYR
OT
Vasopressin and oxytocin
A
Human
X-ray
6TPK
6TPK_refined
3.2
A
Inactive
14
68
-
-
-
-
GlgA glycogen synthase
-
retosiban
small-molecule
Antagonist
oxytocin, vasopressin
peptide
Yes
No
Waltenspuhl Y, Schoppe J, Ehrenmann J, Kummer L, Pluckthun A
10.1126/SCIADV.ABB5419
2020-08-05
Yes
SCTR
secretin
Glucagon
B1
Human
cryo-EM
6WI9
6WI9_refined
4.3
R
Active
100
84
Gs
αs
-
49
-
Nanobody-35
SECRETIN
protein
Agonist
secretin, VIP
peptide
No
No
Dong M, Deganutti G, Piper SJ, Liang YL, Khoshouei M, Belousoff MJ, Harikumar KG, Reynolds CA, Glukhova A, Furness SGB, Christopoulos A, Danev R, Wootten D, Sexton PM, Miller LJ
10.1038/S41467-020-17791-4
2020-08-12
Yes
CXCR2
CXCR2
Chemokine
A
Human
X-ray
6LFL
6LFL_refined
3.2
A
Inactive
4
76
-
-
-
-
GlgA glycogen synthase
-
4-[[3,4-Dioxo-2-[[(1R)-1-(4-propan-2-ylfuran-2-yl)propyl]amino]cyclobuten-1-yl]amino]-3-hydroxy-N,N-dimethylpyridine-2-carboxamide
small-molecule
Allosteric antagonist
CXCL7, CXCL8, CXCL6, CXCL2, CXCL1, CXCL5, CXCL3
peptide
No
No
Liu K, Wu L, Yuan S, Wu M, Xu Y, Sun Q, Li S, Zhao S, Hua T, Liu ZJ
10.1038/S41586-020-2492-5
2020-09-02
Yes
CXCR2
CXCR2
Chemokine
A
Human
cryo-EM
6LFM
6LFM_refined
3.5
R
Active
100
85
Gi/o
αi1
-
65
-
scFv16
Interleukin-8
protein
Agonist
CXCL7, CXCL8, CXCL6, CXCL2, CXCL1, CXCL5, CXCL3
peptide
No
No
Liu K, Wu L, Yuan S, Wu M, Xu Y, Sun Q, Li S, Zhao S, Hua T, Liu ZJ
10.1038/S41586-020-2492-5
2020-09-02
Yes
GPBAR
GPBA
Bile acid
A
Human
cryo-EM
7CFN
7CFN_refined
3.0
R
Active
100
83
Gs
αs
-
59
-
Nanobody-35
INT-777
INT-777
small-molecule small-molecule
Agonist PAM
lithocholic acid, chenodeoxycholic acid, cholic acid, deoxycholic acid
small-molecule
No
No
Yang F, Mao C, Guo L, Lin J, Ming Q, Xiao P, Wu X, Shen Q, Guo S, Shen DD, Lu R, Zhang L, Huang S, Ping Y, Zhang C, Ma C, Zhang K, Liang X, Shen Y, Nan F, Yi F, Luca VC, Zhou J, Jiang C, Sun JP, Xie X, Yu X, Zhang Y
10.1038/S41586-020-2569-1
2020-09-09
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
3OE6
-
3.2
A
Inactive
3
77
-
-
-
-
T4-Lysozyme
-
isothiourea-1t
small-molecule
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC
10.1126/SCIENCE.1194396
2010-10-27
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
3OE9
-
3.1
A
Inactive
3
74
-
-
-
-
T4-Lysozyme
-
isothiourea-1t
small-molecule
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC
10.1126/SCIENCE.1194396
2010-10-27
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2Y03
2Y03_refined
2.9
B
Inactive
0
62
-
-
-
-
-
-
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG
10.1038/NATURE09746
2011-01-12
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3P0G
3P0G_refined
3.5
A
Active
100
69
-
-
-
-
T4-Lysozyme
Nanobody
CHEMBL1615159
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Rasmussen SG, Choi HJ, Fung JJ, Pardon E, Casarosa P, Chae PS, Devree BT, Rosenbaum DM, Thian FS, Kobilka TS, Schnapp A, Konetzki I, Sunahara RK, Gellman SH, Pautsch A, Steyaert J, Weis WI, Kobilka BK
10.1038/NATURE09648
2011-01-19
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
2YDO
2YDO_refined
3.0
A
Active
74
73
-
-
-
-
-
-
adenosine
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Lebon G, Warne T, Edwards PC, Bennett K, Langmead CJ, Leslie AG, Tate CG
10.1038/NATURE10136
2011-05-18
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2YCX
-
3.3
A
Inactive
0
59
-
-
-
-
-
-
(S)-Cyanopindolol
small-molecule
Antagonist
-
-
Yes
No
Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF
10.1073/PNAS.1100185108
2011-06-01
Yes
HRH1
H1
Histamine
A
Human
X-ray
3RZE
3RZE_refined
3.1
A
Inactive
3
55
-
-
-
-
T4-Lysozyme
-
doxepin
small-molecule
Antagonist
histamine
small-molecule
Yes
No
Shimamura T, Shiroishi M, Weyand S, Tsujimoto H, Winter G, Katritch V, Abagyan R, Cherezov V, Liu W, Han GW, Kobayashi T, Stevens RC, Iwata S
10.1038/NATURE10236
2011-06-15
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3PWH
-
3.3
A
Inactive
1
71
-
-
-
-
-
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Dore AS, Robertson N, Errey JC, Ng I, Hollenstein K, Tehan B, Hurrell E, Bennett K, Congreve M, Magnani F, Tate CG, Weir M, Marshall FH
10.1016/J.STR.2011.06.014
2011-09-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4A4M
4A4M_refined
3.3
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Deupi X, Edwards P, Singhal A, Nickle B, Oprian D, Schertler G, Standfuss J
10.1073/PNAS.1114089108
2012-01-25
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
X-ray
3V2W
-
3.4
A
Inactive
1
68
-
-
-
-
T4-Lysozyme
-
W146
small-molecule
Antagonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Hanson MA, Roth CB, Jo E, Griffith MT, Scott FL, Reinhart G, Desale H, Clemons B, Cahalan SM, Schuerer SC, Sanna MG, Han GW, Kuhn P, Rosen H, Stevens RC
10.1126/SCIENCE.1215904
2012-02-15
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3UZC
3UZC_refined
3.3
A
Inactive
1
71
-
-
-
-
-
-
CHEMBL2024114
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Congreve M, Andrews SP, Doré AS, Hollenstein K, Hurrell E, Langmead CJ, Mason JS, Ng IW, Tehan B, Zhukov A, Weir M, Marshall FH.
10.1021/jm201376w
2012-03-21
Yes
OPRX
NOP
Opioid
A
Human
X-ray
4EA3
4EA3_refined
3.0
A
Inactive
3
75
-
-
-
-
BRIL
-
compound 24 [PMID: 16451050]
small-molecule
Antagonist
nociceptin/orphanin FQ
peptide
Yes
No
Thompson AA, Liu W, Chun E, Katritch V, Wu H, Vardy E, Huang XP, Trapella C, Guerrini R, Calo G, Roth BL, Cherezov V, Stevens RC
10.1038/NATURE11085
2012-04-25
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
4EIY
4EIY_refined
1.8
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Liu W, Chun E, Thompson AA, Chubukov P, Xu F, Katritch V, Han GW, Roth CB, Heitman LH, IJzerman AP, Cherezov V, Stevens RC
10.1126/SCIENCE.1219218
2012-07-25
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
4GPO
4GPO_refined
3.5
B
Inactive
0
58
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Huang J, Chen S, Zhang JJ, Huang XY
10.1038/NSMB.2504
2013-02-27
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
4IB4
4IB4_refined
2.7
A
Intermediate
42
59
-
-
-
-
BRIL
-
ergotamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Wacker D, Wang C, Katritch V, Han GW, Huang XP, Vardy E, McCorvy JD, Jiang Y, Chu M, Siu FY, Liu W, Xu HE, Cherezov V, Roth BL, Stevens RC
10.1126/science.1232808
2013-03-13
Yes
SMO
SMO
Frizzled
F
Human
X-ray
4JKV
4JKV_refined
2.5
A
Inactive
0
44
-
-
-
-
BRIL
-
taladegib
small-molecule
Antagonist
-
-
No
No
Wang C, Wu H, Katritch V, Han GW, Huang XP, Liu W, Siu FY, Roth BL, Cherezov V, Stevens RC
10.1038/NATURE12167
2013-04-24
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
4LDL
4LDL_refined
3.1
A
Active
100
69
-
-
-
-
T4-Lysozyme
Nanobody
hydroxybenzylisoproterenol
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ring AM, Manglik A, Kruse AC, Enos MD, Weis WI, Garcia KC, Kobilka BK
10.1038/NATURE12572
2013-09-25
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
4MQT
4MQT_refined
3.7
A
Active
99
59
-
-
-
-
-
Nanobody
iperoxo
LY2119620
small-molecule small-molecule
Agonist PAM
acetylcholine
small-molecule
Yes
No
Kruse AC, Ring AM, Manglik A, Hu J, Hu K, Eitel K, Hubner H, Pardon E, Valant C, Sexton PM, Christopoulos A, Felder CC, Gmeiner P, Steyaert J, Weis WI, Garcia KC, Wess J, Kobilka BK
10.1038/NATURE12735
2013-11-27
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
3ZEV
-
3.0
A
Inactive
2
72
-
-
-
-
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A
10.1073/PNAS.1317903111
2014-01-29
Yes
SMO
SMO
Frizzled
F
Human
X-ray
4O9R
4O9R_refined
3.2
A
Inactive
11
42
-
-
-
-
BRIL
-
cyclopamine
small-molecule
Antagonist
-
-
No
No
Weierstall U, James D, Wang C, White TA, Wang D, Liu W, Spence JC, Bruce Doak R, Nelson G, Fromme P, Fromme R, Grotjohann I, Kupitz C, Zatsepin NA, Liu H, Basu S, Wacker D, Han GW, Katritch V, Boutet S, Messerschmidt M, Williams GJ, Koglin JE, Marvin Seibert M, Klinker M, Gati C, Shoeman RL, Barty A, Chapman HN, Kirian RA, Beyerlein KR, Stevens RC, Li D, Shah ST, Howe N, Caffrey M, Cherezov V
10.1038/NCOMMS4309
2014-03-05
Yes
P2Y12
P2Y12
P2Y
A
Human
X-ray
4PXZ
4PXZ_refined
2.5
A
Intermediate
42
84
-
-
-
-
BRIL
-
2MeSADP
small-molecule
Agonist
ATP, ADP
small-molecule
Yes
No
Zhang J, Zhang K, Gao ZG, Paoletta S, Zhang D, Han GW, Li T, Ma L, Zhang W, Muller CE, Yang H, Jiang H, Cherezov V, Katritch V, Jacobson KA, Stevens RC, Wu B, Zhao Q
10.1038/NATURE13288
2014-04-30
Yes
SMO
SMO
Frizzled
F
Human
X-ray
4QIM
4QIM_refined
2.6
A
Inactive
7
45
-
-
-
-
BRIL
-
ANTA XV
small-molecule
Antagonist
-
-
No
No
Wang C, Wu H, Evron T, Vardy E, Han GW, Huang XP, Hufeisen SJ, Mangano TJ, Urban DJ, Katritch V, Cherezov V, Caron MG, Roth BL, Stevens RC
10.1038/NCOMMS5355
2014-07-23
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Rat
X-ray
4U14
4U14_refined
3.6
A
Inactive
3
47
-
-
-
-
T4-Lysozyme
-
tiotropium
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Thorsen TS, Matt R, Weis WI, Kobilka BK
10.1016/J.STR.2014.08.022
2014-11-26
Yes
OPRD
δ
Opioid
A
Human
X-ray
4RWD
4RWD_refined
2.7
A
Inactive
3
79
-
-
-
-
BRIL
-
DIPP-NH2
peptide
Antagonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
Yes
Fenalti G, Zatsepin NA, Betti C, Giguere P, Han GW, Ishchenko A, Liu W, Guillemyn K, Zhang H, James D, Wang D, Weierstall U, Spence JC, Boutet S, Messerschmidt M, Williams GJ, Gati C, Yefanov OM, White TA, Oberthuer D, Metz M, Yoon CH, Barty A, Chapman HN, Basu S, Coe J, Conrad CE, Fromme R, Fromme P, Tourwe D, Schiller PW, Roth BL, Ballet S, Katritch V, Stevens RC, Cherezov V
10.1038/NSMB.2965
2015-01-14
Yes
P2RY1
P2Y1
P2Y
A
Human
X-ray
4XNV
-
2.2
A
Intermediate
42
78
-
-
-
-
Rubredoxin
-
BMS compound 16 [PMID:23368907]
small-molecule
NAM
ATP, ADP
small-molecule
Yes
No
Zhang D, Gao ZG, Zhang K, Kiselev E, Crane S, Wang J, Paoletta S, Yi C, Ma L, Zhang W, Han GW, Liu H, Cherezov V, Katritch V, Jiang H, Stevens RC, Jacobson KA, Zhao Q, Wu B
10.1038/NATURE14287
2015-04-01
Yes
P2RY1
P2Y1
P2Y
A
Human
X-ray
4XNW
4XNW_refined
2.7
A
Intermediate
42
78
-
-
-
-
Rubredoxin
-
MRS2500
small-molecule
Antagonist
ATP, ADP
small-molecule
Yes
No
Zhang D, Gao ZG, Zhang K, Kiselev E, Crane S, Wang J, Paoletta S, Yi C, Ma L, Zhang W, Han GW, Liu H, Cherezov V, Katritch V, Jiang H, Stevens RC, Jacobson KA, Zhao Q, Wu B
10.1038/NATURE14287
2015-04-01
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
4YAY
4YAY_refined
2.9
A
Inactive
3
79
-
-
-
-
BRIL
-
ZD-7155
small-molecule
Antagonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Zhang H, Unal H, Gati C, Han GW, Liu W, Zatsepin NA, James D, Wang D, Nelson G, Weierstall U, Sawaya MR, Xu Q, Messerschmidt M, Williams GJ, Boutet S, Yefanov OM, White TA, Wang C, Ishchenko A, Tirupula KC, Desnoyer R, Coe J, Conrad CE, Fromme P, Stevens RC, Katritch V, Karnik SS, Cherezov V
10.1016/J.CELL.2015.04.011
2015-04-22
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
X-ray
4Z36
4Z36_refined
2.9
A
Inactive
1
79
-
-
-
-
BRIL
-
ONO-3080573
small-molecule
Antagonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Chrencik JE, Roth CB, Terakado M, Kurata H, Omi R, Kihara Y, Warshaviak D, Nakade S, Asmar-Rovira G, Mileni M, Mizuno H, Griffith MT, Rodgers C, Han GW, Velasquez J, Chun J, Stevens RC, Hanson MA
10.1016/J.CELL.2015.06.002
2015-06-03
Yes
OPSD
Rhodopsin
Opsins
A
Human
X-ray
4ZWJ
4ZWJ_refined
3.3
A
Active
100
94
Visual
S-arrestin
-
86
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Kang Y, Zhou XE, Gao X, He Y, Liu W, Ishchenko A, Barty A, White TA, Yefanov O, Han GW, Xu Q, de Waal PW, Ke J, Tan MH, Zhang C, Moeller A, West GM, Pascal BD, Van Eps N, Caro LN, Vishnivetskiy SA, Lee RJ, Suino-Powell KM, Gu X, Pal K, Ma J, Zhi X, Boutet S, Williams GJ, Messerschmidt M, Gati C, Zatsepin NA, Wang D, James D, Basu S, Roy-Chowdhury S, Conrad CE, Coe J, Liu H, Lisova S, Kupitz C, Grotjohann I, Fromme R, Jiang Y, Tan M, Yang H, Li J, Wang M, Zheng Z, Li D, Howe N, Zhao Y, Standfuss J, Diederichs K, Dong Y, Potter CS, Carragher B, Caffrey M, Jiang H, Chapman HN, Spence JC, Fromme P, Weierstall U, Ernst OP, Katritch V, Gurevich VV, Griffin PR, Hubbell WL, Stevens RC, Cherezov V, Melcher K, Xu HE
10.1038/NATURE14656
2015-07-29
Yes
OX1R
OX1
Orexin
A
Human
X-ray
4ZJ8
4ZJ8_refined
2.8
A
Inactive
1
72
-
-
-
-
GlgA glycogen synthase
-
suvorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Yin J, Babaoglu K, Brautigam CA, Clark L, Shao Z, Scheuermann TH, Harrell CM, Gotter AL, Roecker AJ, Winrow CJ, Renger JJ, Coleman PJ, Rosenbaum DM
10.1038/NSMB.3183
2016-03-09
Yes
OPSD
Rhodopsin
Opsins
A
Human
X-ray
5DGY
5DGY_refined
7.7
A
Active
100
94
Visual
S-arrestin
-
86
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhou XE, Gao X, Barty A, Kang Y, He Y, Liu W, Ishchenko A, White TA, Yefanov O, Han GW, Xu Q, de Waal PW, Suino-Powell KM, Boutet S, Williams GJ, Wang M, Li D, Caffrey M, Chapman HN, Spence JC, Fromme P, Weierstall U, Stevens RC, Cherezov V, Melcher K, Xu HE
10.1038/SDATA.2016.21
2016-03-23
Yes
SMO
SMO
Frizzled
F
Human
X-ray
5L7I
5L7I_refined
3.3
B
Inactive
4
59
-
-
-
-
BRIL
-
vismodegib
small-molecule
Antagonist
-
-
No
No
Byrne EFX, Sircar R, Miller PS, Hedger G, Luchetti G, Nachtergaele S, Tully MD, Mydock-McGrane L, Covey DF, Rambo RP, Sansom MSP, Newstead S, Rohatgi R, Siebold C
10.1038/NATURE18934
2016-07-20
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
5GLH
5GLH_refined
2.8
A
Inactive
14
66
-
-
-
-
T4-Lysozyme
-
ENDOTHELIN
protein
Agonist
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Nishizawa T, Okuta A, Tani K, Dohmae N, Fujiyoshi Y, Nureki O, Doi T
10.1038/nature19319
2016-09-07
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
5TGZ
5TGZ_refined
2.8
A
Inactive
9
61
-
-
-
-
Flavodoxin
-
AM6538
small-molecule
Antagonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Vemuri K, Pu M, Qu L, Han GW, Wu Y, Zhao S, Shui W, Li S, Korde A, Laprairie RB, Stahl EL, Ho JH, Zvonok N, Zhou H, Kufareva I, Wu B, Zhao Q, Hanson MA, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ
10.1016/J.CELL.2016.10.004
2016-11-02
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
5T04
5T04_refined
3.3
A
Active
92
69
-
-
-
-
T4-Lysozyme
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Krumm BE, Lee S, Bhattacharya S, Botos I, White CF, Du H, Vaidehi N, Grisshammer R
10.1038/SREP38564
2016-12-21
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
5TE3
5TE3_refined
2.7
A
Active
97
94
-
-
-
-
-
-
B-Octylglucoside
small-molecule
unknown
-
-
No
No
Gulati S, Jastrzebska B, Banerjee S, Placeres AL, Miszta P, Gao S, Gunderson K, Tochtrop GP, Filipek S, Katayama K, Kiser PD, Mogi M, Stewart PL, Palczewski K
10.1073/PNAS.1617446114
2017-03-15
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
5UNH
5UNH_refined
2.9
B
Active
99
75
-
-
-
-
BRIL
-
compound 2 [PMID: 28379944]
small-molecule
Antagonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K, Tolstikova A, White TA, Hunter MS, Weierstall U, Liu W, Babaoglu K, Moore EL, Katz RD, Shipman JM, Garcia-Calvo M, Sharma S, Sheth P, Soisson SM, Stevens RC, Katritch V, Cherezov V
10.1038/NATURE22035
2017-04-05
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
5UZ7
5UZ7_refined
4.1
R
Active
100
56
Gs
αs
-
47
-
-
-
-
-
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
Liang YL, Khoshouei M, Radjainia M, Zhang Y, Glukhova A, Tarrasch J, Thal DM, Furness SGB, Christopoulos G, Coudrat T, Danev R, Baumeister W, Miller LJ, Christopoulos A, Kobilka BK, Wootten D, Skiniotis G, Sexton PM
10.1038/NATURE22327
2017-05-03
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
5VEW
5VEW_refined
2.7
A
Inactive
0
57
-
-
-
-
T4-Lysozyme
-
PF-06372222
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Song G, Yang D, Wang Y, de Graaf C, Zhou Q, Jiang S, Liu K, Cai X, Dai A, Lin G, Liu D, Wu F, Wu Y, Zhao S, Ye L, Han GW, Lau J, Wu B, Hanson MA, Liu ZJ, Wang MW, Stevens RC
10.1038/NATURE22378
2017-05-24
Yes
GLR
glucagon
Glucagon
B1
Human
X-ray
5XF1
5XF1_refined
3.2
B
Inactive
0
81
-
-
-
-
T4-Lysozyme
Antibody
NNC0640
small-molecule
NAM
glucagon
peptide
No
No
Zhang H, Qiao A, Yang D, Yang L, Dai A, de Graaf C, Reedtz-Runge S, Dharmarajan V, Zhang H, Han GW, Grant TD, Sierra RG, Weierstall U, Nelson G, Liu W, Wu Y, Ma L, Cai X, Lin G, Wu X, Geng Z, Dong Y, Song G, Griffin PR, Lau J, Cherezov V, Yang H, Hanson MA, Stevens RC, Zhao Q, Jiang H, Wang MW, Wu B
10.1038/NATURE22363
2017-05-24
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
5NX2
-
3.7
A
Intermediate
30
84
-
-
-
-
-
-
Truncated protein agonist
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Jazayeri A, Rappas M, Brown AJH, Kean J, Errey JC, Robertson NJ, Fiez-Vandal C, Andrews SP, Congreve M, Bortolato A, Mason JS, Baig AH, Teobald I, Dore AS, Weir M, Cooke RM, Marshall FH
10.1038/NATURE22800
2017-06-14
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5MZJ
5MZJ_refined
2.0
A
Inactive
1
71
-
-
-
-
BRIL
-
theophylline
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM
10.1016/j.str.2017.06.012
2017-07-26
Yes
AA1R
A1
Adenosine
A
Human
X-ray
5N2S
5N2S_refined
3.3
A
Inactive
1
86
-
-
-
-
BRIL
-
PSB36
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM
10.1016/j.str.2017.06.012
2017-07-26
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
5X93
5X93_refined
2.2
A
Inactive
5
71
-
-
-
-
T4-Lysozyme
-
K-8794
small-molecule
Antagonist
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Nishizawa T, Yamashita K, Inoue A, Hirata K, Kadji FMN, Okuta A, Tani K, Aoki J, Fujiyoshi Y, Doi T, Nureki O
10.1038/NSMB.3450
2017-08-16
Yes
Q08BG4
LPA6
Lysophospholipid (LPA)
A
Zebrafish
X-ray
5XSZ
5XSZ_refined
3.2
A
Intermediate
42
78
-
-
-
-
T4-Lysozyme
-
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Taniguchi R, Inoue A, Sayama M, Uwamizu A, Yamashita K, Hirata K, Yoshida M, Tanaka Y, Kato HE, Nakada-Nakura Y, Otani Y, Nishizawa T, Doi T, Ohwada T, Ishitani R, Aoki J, Nureki O
10.1038/NATURE23448
2017-08-16
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5NM2
5NM2_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Weinert T, Olieric N, Cheng R, Brunle S, James D, Ozerov D, Gashi D, Vera L, Marsh M, Jaeger K, Dworkowski F, Panepucci E, Basu S, Skopintsev P, Dore AS, Geng T, Cooke RM, Liang M, Prota AE, Panneels V, Nogly P, Ermler U, Schertler G, Hennig M, Steinmetz MO, Wang M, Standfuss J
10.1038/S41467-017-00630-4
2017-09-27
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5VRA
5VRA_refined
2.4
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Broecker J, Morizumi T, Ou WL, Klingel V, Kuo A, Kissick DJ, Ishchenko A, Lee MY, Xu S, Makarov O, Cherezov V, Ogata CM, Ernst OP
10.1038/NPROT.2017.135
2017-12-13
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OLG
5OLG_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OLZ
5OLZ_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL2024114
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
GLR
glucagon
Glucagon
B1
Human
X-ray
5YQZ
5YQZ_refined
3.0
R
Inactive
3
83
-
-
-
-
T4-Lysozyme
-
NNC1702
peptide
Agonist (partial)
glucagon
peptide
No
No
Zhang H, Qiao A, Yang L, Van Eps N, Frederiksen KS, Yang D, Dai A, Cai X, Zhang H, Yi C, Cao C, He L, Yang H, Lau J, Ernst OP, Hanson MA, Stevens RC, Wang MW, Reedtz-Runge S, Jiang H, Zhao Q, Wu B
10.1038/NATURE25153
2018-01-17
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6B3J
6B3J_refined
3.3
R
Active
100
82
Gs
αs
-
49
-
-
Exendin-P5
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Liang YL, Khoshouei M, Glukhova A, Furness SGB, Zhao P, Clydesdale L, Koole C, Truong TT, Thal DM, Lei S, Radjainia M, Danev R, Baumeister W, Wang MW, Miller LJ, Christopoulos A, Sexton PM, Wootten D
10.1038/NATURE25773
2018-02-21
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FKC
6FKC_refined
2.5
A
Active
97
94
-
-
-
-
-
-
3-[1'-[(2~{S})-2-(4-chlorophenyl)-3-methyl-butanoyl]spiro[1,3-benzodioxole-2,4'-piperidine]-5-yl]propanoic acid
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
AA2AR
A2A
Adenosine
A
Human
cryo-EM
6GDG
6GDG_refined
4.1
A
Active
100
64
Gs
αs
-
57
TrxA
Nanobody-35
NECA
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Garcia-Nafria J, Lee Y, Bai X, Carpenter B, Tate CG
10.7554/ELIFE.35946
2018-05-16
Yes
Q80KM9
US28
Unclassified
A
strain AD169
X-ray
5WB2
5WB2_refined
3.5
A
Active
99
82
-
-
-
-
-
Nanobody
CX3 CL1
peptide
Agonist
-
-
Yes
No
Miles TF, Spiess K, Jude KM, Tsutsumi N, Burg JS, Ingram JR, Waghray D, Hjorto GM, Larsen O, Ploegh HL, Rosenkilde MM, Garcia KC
10.7554/ELIFE.35850
2018-06-13
Yes
5HT1B
5-HT1B
5-Hydroxytryptamine
A
Human
cryo-EM
6G79
6G79_refined
3.8
S
Active
100
67
Gi/o
αo
-
59
-
-
donitriptan
small-molecule
Agonist
tryptamine, 5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
Garcia-Nafria J, Nehme R, Edwards PC, Tate CG
10.1038/S41586-018-0241-9
2018-06-20
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
6DRZ
6DRZ_refined
3.1
A
Intermediate
42
61
-
-
-
-
BRIL
-
methysergide
small-molecule
Antagonist
5-hydroxytryptamine
small-molecule
Yes
No
McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL
10.1038/s41594-018-0116-7
2018-08-29
Yes
PD2R2
DP2
Prostanoid
A
Human
X-ray
6D27
6D27_refined
2.7
A
Inactive
24
81
-
-
-
-
T4-Lysozyme
-
CHEMBL179036
small-molecule
Antagonist
PGJ2 , PGD2 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Wang L, Yao D, Deepak RNVK, Liu H, Xiao Q, Fan H, Gong W, Wei Z, Zhang C
10.1016/J.MOLCEL.2018.08.009
2018-10-03
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6H7J
6H7J_refined
2.8
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb80
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG
10.1126/SCIENCE.AAU5595
2018-10-17
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6H7N
6H7N_refined
2.5
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb6B9
(S)-Xamoterol
small-molecule
Agonist
-
-
Yes
No
-
10.1101/436212
2018-10-17
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
5YC8
5YC8_refined
2.5
A
Inactive
3
60
-
-
-
-
BRIL
-
N-methyl scopolamine
small-molecule
Antagonist
acetylcholine
small-molecule
No
No
Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T
10.1038/S41589-018-0152-Y
2018-11-21
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
5ZKB
5ZKB_refined
3.0
A
Inactive
3
60
-
-
-
-
BRIL
-
AF-DX 384
small-molecule
Antagonist
acetylcholine
small-molecule
No
No
Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T
10.1038/S41589-018-0152-Y
2018-11-21
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
6IGL
-
2.7
A
Inactive
5
70
-
-
-
-
T4-Lysozyme
-
IRL 1620
peptide
Agonist (partial)
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Shihoya W, Izume T, Inoue A, Yamashita K, Kadji FMN, Hirata K, Aoki J, Nishizawa T, Nureki O
10.1038/S41467-018-07094-0
2018-11-21
Yes
PE2R3
EP3
Prostanoid
A
Human
X-ray
6AK3
6AK3_refined
2.9
B
Active
92
69
-
-
-
-
BRIL
-
PGE2
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Morimoto K, Suno R, Hotta Y, Yamashita K, Hirata K, Yamamoto M, Narumiya S, Iwata S, Kobayashi T
10.1038/S41589-018-0171-8
2018-12-05
Yes
TA2R
TP
Prostanoid
A
Human
X-ray
6IIU
6IIU_refined
2.5
A
Intermediate
42
87
-
-
-
-
Rubredoxin
-
ramatroban
small-molecule
Antagonist
PGD2 , thromboxane A2 , PGE2 , PGF2α , PGI2 , PGH2
small-molecule
No
No
Fan H, Chen S, Yuan X, Han S, Zhang H, Xia W, Xu Y, Zhao Q, Wu B
10.1038/S41589-018-0170-9
2018-12-19
Yes
CCR2
CCR2
Chemokine
A
Human
X-ray
6GPS
6GPS_refined
3.3
A
Inactive
16
74
-
-
-
-
Rubredoxin
-
MK-0812
small-molecule
Antagonist
CCL24, CCL2, CCL26, CCL8, CCL13, CCL7, CCL16, CCL11
peptide
No
No
Apel AK, Cheng RKY, Tautermann CS, Brauchle M, Huang CY, Pautsch A, Hennig M, Nar H, Schnapp G
10.1016/J.STR.2018.10.027
2019-01-02
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6IBL
6IBL_refined
2.7
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb80
arformoterol
small-molecule
Agonist
-
-
Yes
No
-
10.1101/436212
2019-01-09
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6HLO
6HLO_refined
2.4
A
Inactive
1
70
-
-
-
-
GlgA glycogen synthase
-
aprepitant
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A
10.1038/S41467-018-07939-8
2019-01-16
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
cryo-EM
6N51
6N51_refined
4.0
B
Intermediate
-
65
-
-
-
-
-
Nanobody-43
quisqualate
small-molecule
Agonist
L-glutamic acid
small-molecule
No
No
Koehl A, Hu H, Feng D, Sun B, Zhang Y, Robertson MJ, Chu M, Kobilka TS, Laeremans T, Steyaert J, Tarrasch J, Dutta S, Fonseca R, Weis WI, Mathiesen JM, Skiniotis G, Kobilka BK
10.1038/S41586-019-0881-4
2019-01-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
6NIY
6NIY_refined
3.3
R
Active
100
55
Gs
αs
-
43
-
-
Calcitonin salmon
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
Dal Maso E, Glukhova A, Zhu Y, Garcia-Nafria J, Tate CG, Atanasio S, Reynolds CA, Ramirez-Aportela E, Carazo JM, Hick CA, Furness SGB, Hay DL, Liang YL, Miller LJ, Christopoulos A, Wang MW, Wootten D, Sexton PM
10.1021/ACSPTSCI.8B00056
2019-01-23
Yes
CNR1
CB1
Cannabinoid
A
Human
cryo-EM
6N4B
6N4B_refined
3.0
R
Active
100
58
Gi/o
αi1
-
62
-
scFv16
MDMB-Fubinaca
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Krishna Kumar K, Shalev-Benami M, Robertson MJ, Hu H, Banister SD, Hollingsworth SA, Latorraca NR, Kato HE, Hilger D, Maeda S, Weis WI, Farrens DL, Dror RO, Malhotra SV, Kobilka BK, Skiniotis G
10.1016/J.CELL.2018.11.040
2019-01-30
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6J20
6J20_refined
2.7
A
Inactive
1
71
-
-
-
-
T4-Lysozyme
-
aprepitant
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
No
No
Chen S, Lu M, Liu D, Yang L, Yi C, Ma L, Zhang H, Liu Q, Frimurer TM, Wang MW, Schwartz TW, Stevens RC, Wu B, Wuthrich K, Zhao Q
10.1038/S41467-019-08568-5
2019-03-06
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
6NBF
6NBF_refined
3.0
R
Active
100
62
Gs
αs
-
58
-
Nanobody-35
Long-acting parathyroid hormone analog
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y
10.1126/SCIENCE.AAV7942
2019-04-17
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
6NBI
6NBI_refined
4.0
R
Active
100
62
Gs
αs
-
56
-
Nanobody-35
Long-acting parathyroid hormone analog
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y
10.1126/SCIENCE.AAV7942
2019-04-17
Yes
MTR1A
MT1
Melatonin
A
Human
X-ray
6ME5
6ME5_refined
3.2
A
Inactive
1
83
-
-
-
-
GlgA glycogen synthase
-
agomelatine
small-molecule
Agonist
melatonin
small-molecule
No
No
Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V
10.1038/S41586-019-1141-3
2019-04-24
Yes
MTR1B
MT2
Melatonin
A
Human
X-ray
6ME7
6ME7_refined
3.2
A
Inactive
1
79
-
-
-
-
Rubredoxin
-
2-phenylmelatonin
small-molecule
Agonist
melatonin
small-molecule
No
No
Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V
10.1038/S41586-019-1144-0
2019-04-24
Yes
MTR1B
MT2
Melatonin
A
Human
X-ray
6ME9
6ME9_refined
3.3
B
Inactive
1
79
-
-
-
-
Rubredoxin
-
ramelteon
small-molecule
Agonist
melatonin
small-molecule
No
No
Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V
10.1038/S41586-019-1144-0
2019-04-24
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
cryo-EM
6OIJ
6OIJ_refined
3.3
R
Active
100
64
Gq/11
α11
-
63
-
Antibody fragment
iperoxo
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Maeda S, Qu Q, Robertson MJ, Skiniotis G, Kobilka BK
10.1126/SCIENCE.AAW5188
2019-05-08
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6E67
6E67_refined
3.7
B
Active
100
72
Gs
αs
Fused partial Gs
44
T4-Lysozyme
-
CHEMBL1615159
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Liu X, Xu X, Hilger D, Aschauer P, Tiemann JKS, Du Y, Liu H, Hirata K, Sun X, Guixa-Gonzalez R, Mathiesen JM, Hildebrand PW, Kobilka BK
10.1016/J.CELL.2019.04.021
2019-06-05
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6GT3
6GT3_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
imaradenant
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
-
-
2019-06-26
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6N48
6N48_refined
3.2
A
Active
100
70
-
-
-
-
T4-Lysozyme
Camelid Antibody Fragment
CHEMBL1615159
2-[[(3R)-4-(4-Tert-butylphenyl)-3-[[2-(4-methoxyphenyl)sulfanyl-5-[methyl(propan-2-yl)sulfamoyl]benzoyl]amino]butanoyl]amino]acetic acid
small-molecule small-molecule
Agonist PAM
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Liu X, Masoudi A, Kahsai AW, Huang LY, Pani B, Staus DP, Shim PJ, Hirata K, Simhal RK, Schwalb AM, Rambarat PK, Ahn S, Lefkowitz RJ, Kobilka B
10.1126/SCIENCE.AAW8981
2019-06-26
Yes
SMO
SMO
Frizzled
F
Mouse
X-ray
6O3C
6O3C_refined
2.8
A
Active
95
61
-
-
-
-
-
Nanobody-Smo8
SAG21k
small-molecule
Agonist
-
-
No
No
Deshpande I, Liang J, Hedeen D, Roberts KJ, Zhang Y, Ha B, Latorraca NR, Faust B, Dror RO, Beachy PA, Myers BR, Manglik A
10.1038/S41586-019-1355-4
2019-07-03
Yes
NTR1
NTS1
Neurotensin
A
Human
cryo-EM
6OSA
6OSA_refined
3.0
R
Active
100
77
Gi/o
αi1
Non-canonical conformation
62
-
-
JMV449
peptide
Agonist
large neuromedin N, neurotensin, neuromedin N, large neurotensin
peptide
Yes
No
Kato HE, Zhang Y, Hu H, Suomivuori CM, Kadji FMN, Aoki J, Krishna Kumar K, Fonseca R, Hilger D, Huang W, Latorraca NR, Inoue A, Dror RO, Kobilka BK, Skiniotis G
10.1038/S41586-019-1337-6
2019-07-10
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
6K1Q
6K1Q_refined
2.7
A
Inactive
5
68
-
-
-
-
T4-Lysozyme
-
IRL 2500
peptide
Inverse agonist
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Nagiri C, Shihoya W, Inoue A, Kadji FMN, Aoki J, Nureki O
10.1038/S42003-019-0482-7
2019-07-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
6OYA
6OYA_refined
3.3
R
Active
100
94
Gi/o
αt1
-
59
-
Camelid antibody VHH fragment
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Gao Y, Hu H, Ramachandran S, Erickson JW, Cerione RA, Skiniotis G
10.1016/J.MOLCEL.2019.06.007
2019-07-24
Yes
SUCR1
succinate
Succinate
A
Rat
X-ray
6RNK
6RNK_refined
1.9
A
Intermediate
42
90
-
-
-
-
-
Nanobody-6
NF-56-EJ40
small-molecule
Antagonist
-
-
Yes
No
Haffke M, Fehlmann D, Rummel G, Boivineau J, Duckely M, Gommermann N, Cotesta S, Sirockin F, Freuler F, Littlewood-Evans A, Kaupmann K, Jaakola VP
10.1038/S41586-019-1663-8
2019-08-14
Yes
CCR7
CCR7
Chemokine
A
Human
X-ray
6QZH
6QZH_refined
2.1
A
Inactive
4
71
-
-
-
-
Sialidase NanA
-
SCHEMBL13407377
small-molecule
Allosteric antagonist
CCL21, CCL19
peptide
No
No
Jaeger K, Bruenle S, Weinert T, Guba W, Muehle J, Miyazaki T, Weber M, Furrer A, Haenggi N, Tetaz T, Huang CY, Mattle D, Vonach JM, Gast A, Kuglstatter A, Rudolph MG, Nogly P, Benz J, Dawson RJP, Standfuss J
10.1016/J.CELL.2019.07.028
2019-09-04
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6JZH
6JZH_refined
2.3
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Shimazu Y, Tono K, Tanaka T, Yamanaka Y, Nakane T, Mori C, Terakado Kimura K, Fujiwara T, Sugahara M, Tanaka R, Doak RB, Shimamura T, Iwata S, Nango E, Yabashi M
10.1107/S1600576719012846
2019-10-30
Yes
CLTR1
CysLT1
Leukotriene
A
Human
X-ray
6RZ5
6RZ5_refined
2.5
B
Intermediate
42
84
-
-
-
-
BRIL
-
zafirlukast
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
Yes
Yes
Luginina A, Gusach A, Marin E, Mishin A, Brouillette R, Popov P, Shiriaeva A, Besserer-Offroy E, Longpre JM, Lyapina E, Ishchenko A, Patel N, Polovinkin V, Safronova N, Bogorodskiy A, Edelweiss E, Hu H, Weierstall U, Liu W, Batyuk A, Gordeliy V, Han GW, Sarret P, Katritch V, Borshchevskiy V, Cherezov V
10.1126/SCIADV.AAX2518
2019-10-30
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
6KK1
6KK1_refined
2.8
B
Inactive
0
57
-
-
-
-
T4-Lysozyme
-
PF-06372222
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Xu Y, Wang Y, Wang Y, Liu K, Peng Y, Yao D, Tao H, Liu H, Song G
10.1107/S2052252519013496
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PRZ
6PRZ_refined
2.8
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
CHEMBL1160734
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS1
6PS1_refined
3.2
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
timolol
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS3
6PS3_refined
2.5
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
CHEMBL3799125
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS5
6PS5_refined
2.9
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
propranolol
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6PS7
6PS7_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
cryo-EM
6NI3
6NI3_refined
3.8
R
Active
100
69
Gs
αs
-
59
-
Nanobody-35
CHEMBL1615159
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Nguyen AH, Thomsen ARB, Cahill TJ 3rd, Huang R, Huang LY, Marcink T, Clarke OB, Heissel S, Masoudi A, Ben-Hail D, Samaan F, Dandey VP, Tan YZ, Hong C, Mahoney JP, Triest S, Little J 4th, Chen X, Sunahara R, Steyaert J, Molina H, Yu Z, des Georges A, Lefkowitz RJ
10.1038/S41594-019-0330-Y
2019-11-20
Yes
ADA2A
α2A
Adrenoceptors
A
Human
X-ray
6KUX
6KUX_refined
2.7
A
Inactive
1
57
-
-
-
-
BRIL
-
RSC
small-molecule
Antagonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2019-12-04
Yes
ADA2A
α2A
Adrenoceptors
A
Human
X-ray
6KUY
6KUY_refined
3.2
A
Inactive
1
56
-
-
-
-
BRIL
-
(2~{S})-4-fluoranyl-2-(1~{H}-imidazol-5-yl)-1-propan-2-yl-2,3-dihydroindole
small-molecule
Agonist (partial)
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2019-12-04
Yes
ACM5
M5
Acetylcholine (muscarinic)
A
Human
X-ray
6OL9
6OL9_refined
2.5
A
Inactive
3
53
-
-
-
-
T4-Lysozyme
-
tiotropium
small-molecule
Inverse agonist
acetylcholine
small-molecule
No
No
Vuckovic Z, Gentry PR, Berizzi AE, Hirata K, Varghese S, Thompson G, van der Westhuizen ET, Burger WAC, Rahmani R, Valant C, Langmead CJ, Lindsley CW, Baell JB, Tobin AB, Sexton PM, Christopoulos A, Thal DM
10.1073/PNAS.1914446116
2019-12-11
Yes
OPRD
δ
Opioid
A
Human
X-ray
6PT3
6PT3_refined
3.3
A
Active
74
78
-
-
-
-
BRIL
-
DPI-287
small-molecule
Agonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
No
No
Claff T, Yu J, Blais V, Patel N, Martin C, Wu L, Han GW, Holleran BJ, Van der Poorten O, White KL, Hanson MA, Sarret P, Gendron L, Cherezov V, Katritch V, Ballet S, Liu ZJ, Muller CE, Stevens RC
10.1126/SCIADV.AAX9115
2019-12-11
Yes
CLTR2
CysLT2
Leukotriene
A
Human
X-ray
6RZ6
6RZ6_refined
2.4
A
Intermediate
42
82
-
-
-
-
BRIL
-
ONO-2570366
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
No
No
Gusach A, Luginina A, Marin E, Brouillette RL, Besserer-Offroy E, Longpre JM, Ishchenko A, Popov P, Patel N, Fujimoto T, Maruyama T, Stauch B, Ergasheva M, Romanovskaia D, Stepko A, Kovalev K, Shevtsov M, Gordeliy V, Han GW, Katritch V, Borshchevskiy V, Sarret P, Mishin A, Cherezov V
10.1038/S41467-019-13348-2
2019-12-11
Yes
CLTR2
CysLT2
Leukotriene
A
Human
X-ray
6RZ8
6RZ8_refined
2.7
A
Intermediate
42
78
-
-
-
-
BRIL
-
ONO-2080365
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
No
No
Gusach A, Luginina A, Marin E, Brouillette RL, Besserer-Offroy E, Longpre JM, Ishchenko A, Popov P, Patel N, Fujimoto T, Maruyama T, Stauch B, Ergasheva M, Romanovskaia D, Stepko A, Kovalev K, Shevtsov M, Gordeliy V, Han GW, Katritch V, Borshchevskiy V, Sarret P, Mishin A, Cherezov V
10.1038/S41467-019-13348-2
2019-12-11
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TO7
-
2.3
A
Inactive
1
71
-
-
-
-
-
-
suvorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TP3
6TP3_refined
3.0
A
Inactive
1
74
-
-
-
-
-
-
daridorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TP6
6TP6_refined
2.3
B
Inactive
1
71
-
-
-
-
-
-
filorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX2R
OX2
Orexin
A
Human
X-ray
6TPN
6TPN_refined
2.6
A
Inactive
1
71
-
-
-
-
GlgA glycogen synthase
-
HTL6641
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TQ4
6TQ4_refined
2.3
B
Inactive
1
70
-
-
-
-
-
-
CHEMBL4590386
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
CXCR4
CXCR4
Chemokine
A
Human
X-ray
3OE8
-
3.1
A
Inactive
3
76
-
-
-
-
T4-Lysozyme
-
isothiourea-1t
small-molecule
Antagonist
CXCL12ε, CXCL12β, CXCL12φ, CXCL12α, CXCL12, CXCL12γ, CXCL12δ
peptide
Yes
No
Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC
10.1126/SCIENCE.1194396
2010-10-27
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2Y04
2Y04_refined
3.1
B
Inactive
0
62
-
-
-
-
-
-
levosalbutamol
small-molecule
Agonist (partial)
-
-
Yes
No
Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG
10.1038/NATURE09746
2011-01-12
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
3PQR
-
2.9
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Choe HW, Kim YJ, Park JH, Morizumi T, Pai EF, Krauss N, Hofmann KP, Scheerer P, Ernst OP
10.1038/NATURE09789
2011-03-09
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3QAK
3QAK_refined
2.7
A
Active
74
69
-
-
-
-
T4-Lysozyme
-
UK-432,097
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Xu F, Wu H, Katritch V, Han GW, Jacobson KA, Gao ZG, Cherezov V, Stevens RC
10.1126/SCIENCE.1202793
2011-03-09
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
2YCZ
2YCZ_refined
3.7
B
Inactive
0
60
-
-
-
-
-
-
Iodocyanopindolol
small-molecule
Antagonist
-
-
Yes
No
Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF
10.1073/PNAS.1100185108
2011-06-01
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
3SN6
3SN6_refined
3.2
R
Active
100
69
Gs
αs
-
89
T4-Lysozyme
Antibody
CHEMBL1615159
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Rasmussen SG, DeVree BT, Zou Y, Kruse AC, Chung KY, Kobilka TS, Thian FS, Chae PS, Pardon E, Calinski D, Mathiesen JM, Shah ST, Lyons JA, Caffrey M, Gellman SH, Steyaert J, Skiniotis G, Weis WI, Sunahara RK, Kobilka BK
10.1038/NATURE10361
2011-07-20
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
3VG9
3VG9_refined
2.7
A
Inactive
1
72
-
-
-
-
-
Antibody fab fragment light chain Antibody fab fragment heavy chain
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Hino T, Arakawa T, Iwanari H, Yurugi-Kobayashi T, Ikeda-Suno C, Nakada-Nakura Y, Kusano-Arai O, Weyand S, Shimamura T, Nomura N, Cameron AD, Kobayashi T, Hamakubo T, Iwata S, Murata T
10.1038/NATURE10750
2012-02-01
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Rat
X-ray
4DAJ
-
3.4
A
Inactive
3
46
-
-
-
-
T4-Lysozyme
-
tiotropium
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Kruse AC, Hu J, Pan AC, Arlow DH, Rosenbaum DM, Rosemond E, Green HF, Liu T, Chae PS, Dror RO, Shaw DE, Weis WI, Wess J, Kobilka BK
10.1038/NATURE10867
2012-02-22
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
4AMI
4AMI_refined
3.2
A
Inactive
0
58
-
-
-
-
-
-
Bucindolol
small-molecule
Agonist
-
-
Yes
No
Warne T, Edwards PC, Leslie AG, Tate CG
10.1016/J.STR.2012.03.014
2012-05-23
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
4GBR
4GBR_refined
4.0
A
Inactive
0
69
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Zou Y, Weis WI, Kobilka BK
10.1371/JOURNAL.PONE.0046039
2012-10-24
Yes
5HT1B
5-HT1B
5-Hydroxytryptamine
A
Human
X-ray
4IAR
4IAR_refined
2.7
A
Inactive
14
70
-
-
-
-
BRIL
-
ergotamine
small-molecule
Agonist
tryptamine, 5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
Wang C, Jiang Y, Ma J, Wu H, Wacker D, Katritch V, Han GW, Liu W, Huang XP, Vardy E, McCorvy JD, Gao X, Zhou XE, Melcher K, Zhang C, Bai F, Yang H, Yang L, Jiang H, Roth BL, Cherezov V, Stevens RC, Xu HE
10.1126/SCIENCE.1232807
2013-03-13
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4BEZ
-
3.3
A
Active
97
94
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Singhal A, Ostermaier MK, Vishnivetskiy SA, Panneels V, Homan KT, Tesmer JJ, Veprintsev D, Deupi X, Gurevich VV, Schertler GF, Standfuss J
10.1038/EMBOR.2013.44
2013-04-24
Yes
CRFR1
CRF1
Corticotropin-releasing factor
B1
Human
X-ray
4K5Y
-
3.0
C
Inactive
16
60
-
-
-
-
T4-Lysozyme
-
CP 376,395
small-molecule
Antagonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2
peptide
No
No
Hollenstein K, Kean J, Bortolato A, Cheng RK, Dore AS, Jazayeri A, Cooke RM, Weir M, Marshall FH
10.1038/NATURE12357
2013-07-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4J4Q
4J4Q_refined
2.7
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
B-Octylglucoside
small-molecule
unknown
-
-
No
No
Park JH, Morizumi T, Li Y, Hong JE, Pai EF, Hofmann KP, Choe HW, Ernst OP
10.1002/ANIE.201302374
2013-10-30
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
4NC3
4NC3_refined
2.8
A
Intermediate
42
60
-
-
-
-
BRIL
-
ergotamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Liu W, Wacker D, Gati C, Han GW, James D, Wang D, Nelson G, Weierstall U, Katritch V, Barty A, Zatsepin NA, Li D, Messerschmidt M, Boutet S, Williams GJ, Koglin JE, Seibert MM, Wang C, Shah ST, Basu S, Fromme R, Kupitz C, Rendek KN, Grotjohann I, Fromme P, Kirian RA, Beyerlein KR, White TA, Chapman HN, Caffrey M, Spence JC, Stevens RC, Cherezov V
10.1126/SCIENCE.1244142
2013-12-18
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4BUO
4BUO_refined
2.8
A
Inactive
2
72
-
-
-
-
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A
10.1073/PNAS.1317903111
2014-01-29
Yes
GRM1
mGlu1
Metabotropic glutamate
C
Human
X-ray
4OR2
4OR2_refined
2.8
B
Inactive
-
22
-
-
-
-
BRIL
-
FITM
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Wu H, Wang C, Gregory KJ, Han GW, Cho HP, Xia Y, Niswender CM, Katritch V, Meiler J, Cherezov V, Conn PJ, Stevens RC
10.1126/science.1249489
2014-03-19
Yes
FFAR1
FFA1
Free fatty acid
A
Human
X-ray
4PHU
4PHU_refined
2.3
A
Intermediate
42
90
-
-
-
-
T4-Lysozyme
-
fasiglifam
small-molecule
Agonist
docosahexaenoic acid, oleic acid, α-linolenic acid, myristic acid
small-molecule
No
No
Srivastava A, Yano J, Hirozane Y, Kefala G, Gruswitz F, Snell G, Lane W, Ivetac A, Aertgeerts K, Nguyen J, Jennings A, Okada K
10.1038/NATURE13494
2014-07-16
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
4PXF
4PXF_refined
2.8
A
Active
100
93
Visual
S-arrestin
Fragment
2
-
-
B-Octylglucoside
small-molecule
unknown
-
-
No
No
Szczepek M, Beyriere F, Hofmann KP, Elgeti M, Kazmin R, Rose A, Bartl FJ, von Stetten D, Heck M, Sommer ME, Hildebrand PW, Scheerer P
10.1038/NCOMMS5801
2014-09-17
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Rat
X-ray
4U15
4U15_refined
2.8
B
Inactive
3
47
-
-
-
-
T4-Lysozyme
-
tiotropium
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
Thorsen TS, Matt R, Weis WI, Kobilka BK
10.1016/J.STR.2014.08.022
2014-11-26
Yes
OX2R
OX2
Orexin
A
Human
X-ray
4S0V
4S0V_refined
2.5
A
Inactive
1
64
-
-
-
-
Glycogen synthase
-
suvorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
Yes
No
Yin J, Mobarec JC, Kolb P, Rosenbaum DM
10.1038/NATURE14035
2015-01-14
Yes
US28
US28
Unclassified
A
strain AD169
X-ray
4XT3
4XT3_refined
3.8
A
Active
99
81
-
-
-
-
-
-
CX3 CL1
peptide
Agonist (partial)
-
-
Yes
No
Burg JS, Ingram JR, Venkatakrishnan AJ, Jude KM, Dukkipati A, Feinberg EN, Angelini A, Waghray D, Dror RO, Ploegh HL, Garcia KC
10.1126/SCIENCE.AAA5026
2015-03-04
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
4UHR
4UHR_refined
2.6
A
Active
74
75
-
-
-
-
-
-
CGS 21680
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Lebon G, Edwards PC, Leslie AG, Tate CG
10.1124/mol.114.097360
2015-04-08
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
X-ray
4Z35
4Z35_refined
2.9
A
Inactive
1
80
-
-
-
-
BRIL
-
ONO-9910539
small-molecule
Antagonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Chrencik JE, Roth CB, Terakado M, Kurata H, Omi R, Kihara Y, Warshaviak D, Nakade S, Asmar-Rovira G, Mileni M, Mizuno H, Griffith MT, Rodgers C, Han GW, Velasquez J, Chun J, Stevens RC, Hanson MA
10.1016/J.CELL.2015.06.002
2015-06-03
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
4XES
4XES_refined
2.6
A
Active
92
72
-
-
-
-
T4-Lysozyme
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Krumm BE, White JF, Shah P, Grisshammer R
10.1038/NCOMMS8895
2015-07-29
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
5CGD
5CGD_refined
2.6
A
Inactive
-
20
-
-
-
-
T4-Lysozyme
-
CHEMBL3603923
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Christopher JA, Aves SJ, Bennett KA, Doré AS, Errey JC, Jazayeri A, Marshall FH, Okrasa K, Serrano-Vega MJ, Tehan BG, Wiggin GR, Congreve M.
10.1021/acs.jmedchem.5b00892
2015-08-12
Yes
OPRX
NOP
Opioid
A
Human
X-ray
5DHH
5DHH_refined
3.0
A
Inactive
3
76
-
-
-
-
BRIL
-
SB 612111
small-molecule
Antagonist
nociceptin/orphanin FQ
peptide
Yes
No
Miller RL, Thompson AA, Trapella C, Guerrini R, Malfacini D, Patel N, Han GW, Cherezov V, Calo G, Katritch V, Stevens RC
10.1016/J.STR.2015.07.024
2015-10-21
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
5D5A
5D5A_refined
2.5
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Huang CY, Olieric V, Ma P, Howe N, Vogeley L, Liu X, Warshamanage R, Weinert T, Panepucci E, Kobilka B, Diederichs K, Wang M, Caffrey M
10.1107/S2059798315021683
2016-01-13
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
X-ray
5CXV
5CXV_refined
2.7
A
Inactive
3
62
-
-
-
-
T4-Lysozyme
-
0HK
small-molecule
Antagonist
acetylcholine
small-molecule
Yes
No
-
-
2016-03-09
Yes
CRFR1
CRF1
Corticotropin-releasing factor
B1
Human
X-ray
4Z9G
-
3.2
A
Inactive
16
63
-
-
-
-
T4-Lysozyme
-
CP 376,395
small-molecule
Antagonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2
peptide
No
No
Dore AS, Bortolato A, Hollenstein K, Cheng RKY, Read RJ, Marshall FH
10.2174/1874467210666170110114727
2016-06-29
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5IUA
5IUA_refined
2.2
A
Inactive
1
72
-
-
-
-
BRIL
-
2-(Furan-2-yl)-5-N-[3-(4-phenylpiperazin-1-yl)propyl]-1H-[1,2,4]triazolo[1,5-a][1,3,5]triazin-8-ium-5,7-diamine
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM.
10.1021/acs.jmedchem.6b00653
2016-06-29
Yes
SMO
SMO
Frizzled
F
Human
X-ray
5L7D
5L7D_refined
3.2
B
Inactive
4
59
-
-
-
-
BRIL
-
-
-
-
-
-
No
No
Byrne EFX, Sircar R, Miller PS, Hedger G, Luchetti G, Nachtergaele S, Tully MD, Mydock-McGrane L, Covey DF, Rambo RP, Sansom MSP, Newstead S, Rohatgi R, Siebold C
10.1038/NATURE18934
2016-07-20
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
5EN0
5EN0_refined
2.8
A
Active
100
94
Gi/o
αt3
Only H5
3
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Singhal A, Guo Y, Matkovic M, Schertler G, Deupi X, Yan EC, Standfuss J
10.15252/EMBR.201642671
2016-08-10
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5K2A
5K2A_refined
2.5
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V
10.1126/SCIADV.1600292
2016-09-21
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5K2D
5K2D_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V
10.1126/SCIADV.1600292
2016-09-21
Yes
CCR2
CCR2
Chemokine
A
Human
X-ray
5T1A
5T1A_refined
2.8
A
Inactive
16
76
-
-
-
-
T4-Lysozyme
-
CCR2-RA-[R]
BMS-681
small-molecule small-molecule
Allosteric antagonist Antagonist
CCL24, CCL2, CCL26, CCL8, CCL13, CCL7, CCL16, CCL11
peptide
No
No
Zheng Y, Qin L, Zacarias NV, de Vries H, Han GW, Gustavsson M, Dabros M, Zhao C, Cherney RJ, Carter P, Stamos D, Abagyan R, Cherezov V, Stevens RC, IJzerman AP, Heitman LH, Tebben A, Kufareva I, Handel TM
10.1038/NATURE20605
2016-12-14
Yes
AA1R
A1
Adenosine
A
Human
X-ray
5UEN
5UEN_refined
3.2
B
Inactive
1
91
-
-
-
-
BRIL
-
DU172
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Glukhova A, Thal DM, Nguyen AT, Vecchio EA, Jorg M, Scammells PJ, May LT, Sexton PM, Christopoulos A
10.1016/j.cell.2017.01.042
2017-03-01
Yes
PAR2
PAR2
Proteinase-activated
A
Human
X-ray
5NDD
5NDD_refined
2.8
A
Intermediate
42
74
-
-
-
-
BRIL
-
AZ8838
small-molecule
Antagonist
-
-
Yes
Yes
Cheng RKY, Fiez-Vandal C, Schlenker O, Edman K, Aggeler B, Brown DG, Brown GA, Cooke RM, Dumelin CE, Dore AS, Geschwindner S, Grebner C, Hermansson NO, Jazayeri A, Johansson P, Leong L, Prihandoko R, Rappas M, Soutter H, Snijder A, Sundstrom L, Tehan B, Thornton P, Troast D, Wiggin G, Zhukov A, Marshall FH, Dekker N
10.1038/NATURE22309
2017-05-03
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
5VEX
5VEX_refined
3.0
B
Inactive
0
57
-
-
-
-
T4-Lysozyme
-
NNC0640
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Song G, Yang D, Wang Y, de Graaf C, Zhou Q, Jiang S, Liu K, Cai X, Dai A, Lin G, Liu D, Wu F, Wu Y, Zhao S, Ye L, Han GW, Lau J, Wu B, Hanson MA, Liu ZJ, Wang MW, Stevens RC
10.1038/NATURE22378
2017-05-17
Yes
G1SGD4
GLP-1
Glucagon
B1
Rabbit
cryo-EM
5VAI
5VAI_refined
4.1
R
Active
100
84
Gs
αs
-
59
-
-
CHEMBL410972
protein
Agonist
-
-
No
No
Zhang Y, Sun B, Feng D, Hu H, Chu M, Qu Q, Tarrasch JT, Li S, Sun Kobilka T, Kobilka BK, Skiniotis G
10.1038/NATURE22394
2017-05-24
Yes
FFAR1
FFA1
Free fatty acid
A
Human
X-ray
5TZY
5TZY_refined
3.2
A
Intermediate
42
91
-
-
-
-
T4-Lysozyme
-
MK-8666
(2S,3R)-3-Cyclopropyl-3-[(2R)-2-[1-[(1S)-1-[5-fluoro-2-(trifluoromethoxy)phenyl]ethyl]piperidin-4-yl]-3,4-dihydro-2H-chromen-7-yl]-2-methylpropanoic acid
small-molecule small-molecule
Agonist PAM
docosahexaenoic acid, oleic acid, α-linolenic acid, myristic acid
small-molecule
No
No
Lu J, Byrne N, Wang J, Bricogne G, Brown FK, Chobanian HR, Colletti SL, Di Salvo J, Thomas-Fowlkes B, Guo Y, Hall DL, Hadix J, Hastings NB, Hermes JD, Ho T, Howard AD, Josien H, Kornienko M, Lumb KJ, Miller MW, Patel SB, Pio B, Plummer CW, Sherborne BS, Sheth P, Souza S, Tummala S, Vonrhein C, Webb M, Allen SJ, Johnston JM, Weinglass AB, Sharma S, Soisson SM
10.1038/NSMB.3417
2017-06-07
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
5XRA
5XRA_refined
2.8
A
Active
96
60
-
-
-
-
Flavodoxin
-
AM11542
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Vemuri K, Nikas SP, Laprairie RB, Wu Y, Qu L, Pu M, Korde A, Jiang S, Ho JH, Han GW, Ding K, Li X, Liu H, Hanson MA, Zhao S, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ
10.1038/NATURE23272
2017-07-12
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5N2R
5N2R_refined
2.8
A
Inactive
1
71
-
-
-
-
BRIL
-
PSB36
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM
10.1016/j.str.2017.06.012
2017-07-26
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
5X7D
5X7D_refined
2.7
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
4-carbamoyl-N-[(2R)-2-cyclohexyl-2-phenylacetyl]-L-phenylalanyl-3-bromo-N-methyl-L-phenylalaninamide
Carazolol
small-molecule small-molecule
Allosteric antagonist Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Liu X, Ahn S, Kahsai AW, Meng KC, Latorraca NR, Pani B, Venkatakrishnan AJ, Masoudi A, Weis WI, Dror RO, Chen X, Lefkowitz RJ, Kobilka BK
10.1038/NATURE23652
2017-08-16
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5NLX
-
2.1
A
Inactive
1
73
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Weinert T, Olieric N, Cheng R, Brunle S, James D, Ozerov D, Gashi D, Vera L, Marsh M, Jaeger K, Dworkowski F, Panepucci E, Basu S, Skopintsev P, Dore AS, Geng T, Cooke RM, Liang M, Prota AE, Panneels V, Nogly P, Ermler U, Schertler G, Hennig M, Steinmetz MO, Wang M, Standfuss J
10.1038/S41467-017-00630-4
2017-09-27
Yes
DRD4
D4
Dopamine
A
Human
X-ray
5WIU
-
2.0
A
Inactive
1
58
-
-
-
-
BRIL
-
[3H]NEMONAPRIDE
small-molecule
Antagonist
dopamine
small-molecule
Yes
No
Wang S, Wacker D, Levit A, Che T, Betz RM, McCorvy JD, Venkatakrishnan AJ, Huang XP, Dror RO, Shoichet BK, Roth BL
10.1126/SCIENCE.AAN5468
2017-10-18
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
5WKT
5WKT_refined
3.2
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
B-Octylglucoside
small-molecule
unknown
-
-
No
No
Broecker J, Morizumi T, Ou WL, Klingel V, Kuo A, Kissick DJ, Ishchenko A, Lee MY, Xu S, Makarov O, Cherezov V, Ogata CM, Ernst OP
10.1038/NPROT.2017.135
2017-12-13
Yes
C5AR1
C5a1
Complement peptide
A
Human
X-ray
5O9H
5O9H_refined
2.7
A
Inactive
6
84
-
-
-
-
-
-
NDT9513727
small-molecule
Antagonist
C3a, C5a, C5a des-Arg, ribosomal protein S19
peptide
Yes
No
Robertson N, Rappas M, Dore AS, Brown J, Bottegoni G, Koglin M, Cansfield J, Jazayeri A, Cooke RM, Marshall FH
10.1038/NATURE25025
2018-01-10
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
5OLV
5OLV_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL1671936
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS
10.1038/S41598-017-18570-W
2018-01-17
Yes
OPRK
κ
Opioid
A
Human
X-ray
6B73
6B73_refined
3.1
A
Active
100
73
-
-
-
-
BRIL
Nanobody
MP1104
small-molecule
Agonist
big dynorphin, β-neoendorphin, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Che T, Majumdar S, Zaidi SA, Ondachi P, McCorvy JD, Wang S, Mosier PD, Uprety R, Vardy E, Krumm BE, Han GW, Lee MY, Pardon E, Steyaert J, Huang XP, Strachan RT, Tribo AR, Pasternak GW, Carroll FI, Stevens RC, Cherezov V, Katritch V, Wacker D, Roth BL
10.1016/J.CELL.2017.12.011
2018-01-17
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
X-ray
6BQH
6BQH_refined
2.7
A
Inactive
1
63
-
-
-
-
BRIL
-
ritanserin
small-molecule
Inverse agonist
5-hydroxytryptamine
small-molecule
Yes
No
Peng Y, McCorvy JD, Harpsoe K, Lansu K, Yuan S, Popov P, Qu L, Pu M, Che T, Nikolajsen LF, Huang XP, Wu Y, Shen L, Bjorn-Yoshimoto WE, Ding K, Wacker D, Han GW, Cheng J, Katritch V, Jensen AA, Hanson MA, Zhao S, Gloriam DE, Roth BL, Stevens RC, Liu ZJ
10.1016/j.cell.2018.01.001
2018-02-14
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
6FFH
6FFH_refined
2.7
A
Inactive
-
21
-
-
-
-
T4-Lysozyme
-
fenobam
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Christopher JA, Orgovan Z, Congreve M, Dore AS, Errey JC, Marshall FH, Mason JS, Okrasa K, Rucktooa P, Serrano-Vega MJ, Ferenczy GG, Keseru GM
10.1021/ACS.JMEDCHEM.7B01722
2018-03-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FK6
6FK6_refined
2.4
A
Active
97
94
-
-
-
-
-
-
COMPOUND SUMMARY
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FK9
6FK9_refined
2.6
A
Active
97
94
-
-
-
-
-
-
(2~{S})-3-methyl-2-phenyl-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6FKD
6FKD_refined
2.5
A
Active
97
94
-
-
-
-
-
-
5-chloro-2-(2-oxo-2-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-ylethyl)-3H-pyridin-6-one
small-molecule
Agonist
-
-
No
No
Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP
10.1073/PNAS.1718084115
2018-04-04
Yes
FFAR1
FFA1
Free fatty acid
A
Human
X-ray
5KW2
5KW2_refined
2.8
A
Intermediate
42
82
-
-
-
-
T4-Lysozyme
-
(3~{S})-3-cyclopropyl-3-[2-[1-[2-[2,2-dimethylpropyl-(6-methylpyridin-2-yl)carbamoyl]-5-methoxy-phenyl]piperidin-4-yl]-1-benzofuran-6-yl]propanoic acid
small-molecule
Allosteric agonist
docosahexaenoic acid, oleic acid, α-linolenic acid, myristic acid
small-molecule
No
No
Ho JD, Chau B, Rodgers L, Lu F, Wilbur KL, Otto KA, Chen Y, Song M, Riley JP, Yang HC, Reynolds NA, Kahl SD, Lewis AP, Groshong C, Madsen RE, Conners K, Lineswala JP, Gheyi T, Saflor MD, Lee MR, Benach J, Baker KA, Montrose-Rafizadeh C, Genin MJ, Miller AR, Hamdouchi C
10.1038/S41467-017-01240-W
2018-05-02
Yes
C5AR1
C5a1
Complement peptide
A
Human
X-ray
6C1Q
6C1Q_refined
2.9
B
Inactive
6
82
-
-
-
-
BRIL
-
PMX53
NDT9513727
peptide small-molecule
Antagonist NAM
C3a, C5a, C5a des-Arg, ribosomal protein S19
peptide
Yes
No
Liu H, Kim HR, Deepak RNVK, Wang L, Chung KY, Fan H, Wei Z, Zhang C
10.1038/S41594-018-0067-Z
2018-05-30
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
6DDF
6DDF_refined
3.5
R
Active
100
71
Gi/o
αi1
-
61
-
-
DAMGO
peptide
Agonist
-
-
Yes
No
Koehl A, Hu H, Maeda S, Zhang Y, Qu Q, Paggi JM, Latorraca NR, Hilger D, Dawson R, Matile H, Schertler GFX, Granier S, Weis WI, Dror RO, Manglik A, Skiniotis G, Kobilka BK
10.1038/S41586-018-0219-7
2018-06-13
Yes
OPSD
Rhodopsin
Opsins
A
Human
cryo-EM
6CMO
6CMO_refined
4.5
R
Active
77
92
Gi/o
αi1
-
100
BRIL
Fab
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Kang Y, Kuybeda O, de Waal PW, Mukherjee S, Van Eps N, Dutka P, Zhou XE, Bartesaghi A, Erramilli S, Morizumi T, Gu X, Yin Y, Liu P, Jiang Y, Meng X, Zhao G, Melcher K, Ernst OP, Kossiakoff AA, Subramaniam S, Xu HE
10.1038/S41586-018-0215-Y
2018-06-20
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
X-ray
6DRY
6DRY_refined
2.9
A
Intermediate
42
60
-
-
-
-
BRIL
-
methylergonovine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL
10.1038/s41594-018-0116-7
2018-08-29
Yes
PD2R2
DP2
Prostanoid
A
Human
X-ray
6D26
6D26_refined
2.8
A
Inactive
24
82
-
-
-
-
T4-Lysozyme
-
fevipiprant
small-molecule
Antagonist
PGJ2 , PGD2 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Wang L, Yao D, Deepak RNVK, Liu H, Xiao Q, Fan H, Gong W, Wei Z, Zhang C
10.1016/J.MOLCEL.2018.08.009
2018-10-03
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6H7L
6H7L_refined
2.7
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb6B9
Dobutamine
small-molecule
Agonist
-
-
Yes
No
Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG
10.1126/SCIENCE.AAU5595
2018-10-17
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
X-ray
6H7O
6H7O_refined
2.8
A
Active
100
60
-
-
-
-
Thioredoxin 1
Camelid antibody fragment Nb6B9
(S)-Cyanopindolol
small-molecule
Agonist
-
-
Yes
No
Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG
10.1126/SCIENCE.AAU5595
2018-10-17
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6MXT
6MXT_refined
3.0
A
Active
99
69
-
-
-
-
T4-Lysozyme
Nanobody-71
salmeterol
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Masureel M, Zou Y, Picard LP, van der Westhuizen E, Mahoney JP, Rodrigues JPGLM, Mildorf TJ, Dror RO, Shaw DE, Bouvier M, Pardon E, Steyaert J, Sunahara RK, Weis WI, Zhang C, Kobilka BK
10.1038/s41589-018-0145-x
2018-11-14
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
X-ray
5ZKC
5ZKC_refined
2.3
A
Inactive
3
60
-
-
-
-
BRIL
-
N-methyl scopolamine
small-molecule
Antagonist
acetylcholine
small-molecule
No
No
Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T
10.1038/S41589-018-0152-Y
2018-11-21
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Rat
X-ray
5ZHP
5ZHP_refined
3.1
B
Inactive
3
47
-
-
-
-
T4-Lysozyme
-
(1R,2R,4S,5S,7s)-7-({[4-fluoro-2-(thiophen-2-yl)phenyl]carbamoyl}oxy)-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium
small-molecule
Antagonist
acetylcholine
small-molecule
No
No
Liu H, Hofmann J, Fish I, Schaake B, Eitel K, Bartuschat A, Kaindl J, Rampp H, Banerjee A, Hubner H, Clark MJ, Vincent SG, Fisher JT, Heinrich MR, Hirata K, Liu X, Sunahara RK, Shoichet BK, Kobilka BK, Gmeiner P
10.1073/PNAS.1813988115
2018-11-28
Yes
PE2R4
EP4
Prostanoid
A
Human
X-ray
5YHL
5YHL_refined
4.2
A
Inactive
11
57
-
-
-
-
-
Fab
ONO-AE3-208-Br
small-molecule
Antagonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
No
No
Toyoda Y, Morimoto K, Suno R, Horita S, Yamashita K, Hirata K, Sekiguchi Y, Yasuda S, Shiroishi M, Shimizu T, Urushibata Y, Kajiwara Y, Inazumi T, Hotta Y, Asada H, Nakane T, Shiimura Y, Nakagita T, Tsuge K, Yoshida S, Kuribara T, Hosoya T, Sugimoto Y, Nomura N, Sato M, Hirokawa T, Kinoshita M, Murata T, Takayama K, Yamamoto M, Narumiya S, Iwata S, Kobayashi T
10.1038/S41589-018-0131-3
2018-12-05
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6E59
6E59_refined
3.4
A
Inactive
1
70
-
-
-
-
GlgA glycogen synthase
-
L760735
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Yin J, Chapman K, Clark LD, Shao Z, Borek D, Xu Q, Wang J, Rosenbaum DM
10.1073/PNAS.1812717115
2018-12-12
Yes
TA2R
TP
Prostanoid
A
Human
X-ray
6IIV
6IIV_refined
3.0
A
Intermediate
42
87
-
-
-
-
Rubredoxin
-
daltroban
small-molecule
Antagonist
PGD2 , thromboxane A2 , PGE2 , PGF2α , PGI2 , PGH2
small-molecule
No
No
Fan H, Chen S, Yuan X, Han S, Zhang H, Xia W, Xu Y, Zhao Q, Wu B
10.1038/S41589-018-0170-9
2018-12-19
Yes
CCR2
CCR2
Chemokine
A
Human
X-ray
6GPX
6GPX_refined
2.7
B
Inactive
16
70
-
-
-
-
Rubredoxin
-
MK-0812
small-molecule
Antagonist
CCL24, CCL2, CCL26, CCL8, CCL13, CCL7, CCL16, CCL11
peptide
No
No
Apel AK, Cheng RKY, Tautermann CS, Brauchle M, Huang CY, Pautsch A, Hennig M, Nar H, Schnapp G
10.1016/J.STR.2018.10.027
2019-01-02
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6HLL
6HLL_refined
3.3
A
Inactive
1
67
-
-
-
-
GlgA glycogen synthase
-
CP 99994
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A
10.1038/S41467-018-07939-8
2019-01-16
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6HLP
6HLP_refined
2.2
A
Inactive
1
71
-
-
-
-
GlgA glycogen synthase
-
netupitant
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A
10.1038/S41467-018-07939-8
2019-01-16
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
cryo-EM
6N52
6N52_refined
4.0
A
Inactive
-
64
-
-
-
-
-
Nanobody-43
-
-
-
L-glutamic acid
small-molecule
No
No
Koehl A, Hu H, Feng D, Sun B, Zhang Y, Robertson MJ, Chu M, Kobilka TS, Laeremans T, Steyaert J, Tarrasch J, Dutta S, Fonseca R, Weis WI, Mathiesen JM, Skiniotis G, Kobilka BK
10.1038/S41586-019-0881-4
2019-01-23
Yes
CNR2
CB2
Cannabinoid
A
Human
X-ray
5ZTY
5ZTY_refined
2.8
A
Inactive
9
80
-
-
-
-
T4-Lysozyme
-
AM10257
small-molecule
Antagonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Li X, Hua T, Vemuri K, Ho JH, Wu Y, Wu L, Popov P, Benchama O, Zvonok N, Locke K, Qu L, Han GW, Iyer MR, Cinar R, Coffey NJ, Wang J, Wu M, Katritch V, Zhao S, Kunos G, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ
10.1016/J.CELL.2018.12.011
2019-01-30
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
6DO1
6DO1_refined
2.9
A
Active
94
85
-
-
-
-
BRIL
Nanobody-Nb.AT110i1
CHEMBL404594
protein
Agonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Wingler LM, McMahon C, Staus DP, Lefkowitz RJ, Kruse AC
10.1016/J.CELL.2018.12.006
2019-01-30
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
6A93
6A93_refined
3.0
A
Inactive
1
60
-
-
-
-
BRIL
-
risperidone
small-molecule
Antagonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Kimura KT, Asada H, Inoue A, Kadji FMN, Im D, Mori C, Arakawa T, Hirata K, Nomura Y, Nomura N, Aoki J, Iwata S, Shimamura T
10.1038/S41594-018-0180-Z
2019-02-13
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
6A94
6A94_refined
2.9
A
Inactive
1
60
-
-
-
-
BRIL
-
zotepine
small-molecule
Antagonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Kimura KT, Asada H, Inoue A, Kadji FMN, Im D, Mori C, Arakawa T, Hirata K, Nomura Y, Nomura N, Aoki J, Iwata S, Shimamura T
10.1038/S41594-018-0180-Z
2019-02-13
Yes
NK1R
NK1
Tachykinin
A
Human
X-ray
6J21
6J21_refined
3.2
A
Inactive
1
71
-
-
-
-
T4-Lysozyme
-
aprepitant
small-molecule
Antagonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Chen S, Lu M, Liu D, Yang L, Yi C, Ma L, Zhang H, Liu Q, Frimurer TM, Wang MW, Schwartz TW, Stevens RC, Wu B, Wuthrich K, Zhao Q
10.1038/S41467-019-08568-5
2019-03-06
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
6NBH
-
3.5
R
Active
100
64
Gs
αs
-
57
-
Nanobody-35
Long-acting parathyroid hormone analog
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y
10.1126/SCIENCE.AAV7942
2019-04-17
Yes
MTR1A
MT1
Melatonin
A
Human
X-ray
6ME2
6ME2_refined
2.8
A
Inactive
1
83
-
-
-
-
GlgA glycogen synthase
-
ramelteon
small-molecule
Agonist
melatonin
small-molecule
No
No
Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V
10.1038/S41586-019-1141-3
2019-04-24
Yes
MTR1A
MT1
Melatonin
A
Human
X-ray
6ME3
6ME3_refined
2.9
A
Inactive
1
82
-
-
-
-
GlgA glycogen synthase
-
2-phenylmelatonin
small-molecule
Agonist
melatonin
small-molecule
No
No
Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V
10.1038/S41586-019-1141-3
2019-04-24
Yes
MTR1A
MT1
Melatonin
A
Human
X-ray
6ME4
6ME4_refined
3.2
A
Inactive
1
83
-
-
-
-
GlgA glycogen synthase
-
2-iodo-melatonin
small-molecule
Agonist
melatonin
small-molecule
No
No
Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V
10.1038/S41586-019-1141-3
2019-04-24
Yes
MTR1B
MT2
Melatonin
A
Human
X-ray
6ME6
6ME6_refined
2.8
B
Inactive
1
78
-
-
-
-
Rubredoxin
-
2-phenylmelatonin
small-molecule
Agonist
melatonin
small-molecule
No
No
Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V
10.1038/S41586-019-1144-0
2019-04-24
Yes
MTR1B
MT2
Melatonin
A
Human
X-ray
6ME8
6ME8_refined
3.1
B
Inactive
1
78
-
-
-
-
Rubredoxin
-
2-phenylmelatonin
small-molecule
Agonist
melatonin
small-molecule
Yes
No
Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V
10.1038/S41586-019-1144-0
2019-04-24
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6MH8
6MH8_refined
4.2
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Martin-Garcia JM, Zhu L, Mendez D, Lee MY, Chun E, Li C, Hu H, Subramanian G, Kissick D, Ogata C, Henning R, Ishchenko A, Dobson Z, Zhang S, Weierstall U, Spence JCH, Fromme P, Zatsepin NA, Fischetti RF, Cherezov V, Liu W
10.1107/S205225251900263X
2019-04-24
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
cryo-EM
6OIK
6OIK_refined
3.6
R
Active
100
60
Gi/o
αo
-
61
-
-
iperoxo
LY2119620
small-molecule small-molecule
Agonist PAM
acetylcholine
small-molecule
Yes
No
Maeda S, Qu Q, Robertson MJ, Skiniotis G, Kobilka BK
10.1126/SCIENCE.AAW5188
2019-05-08
Yes
SMO
SMO
Frizzled
F
Human
cryo-EM
6OT0
-
3.9
R
Active
100
46
Gi/o
αi1
-
100
-
Fab light chain Fab heavy chain
24,25-Epoxy-cholesterol
small-molecule
Agonist
-
-
No
No
Qi X, Liu H, Thompson B, McDonald J, Zhang C, Li X
10.1038/S41586-019-1286-0
2019-06-12
Yes
B1B1U5
Rhodopsin
Opsins
A
Hasarius adansoni
X-ray
6I9K
-
2.2
A
Inactive
16
83
-
-
-
-
-
-
Retinal (11-cis)
small-molecule
Inverse agonist
-
-
Yes
No
Varma N, Mutt E, Muhle J, Panneels V, Terakita A, Deupi X, Nogly P, Schertler GFX, Lesca E
10.1073/PNAS.1902192116
2019-07-03
Yes
NTR1
NTS1
Neurotensin
A
Human
cryo-EM
6OS9
6OS9_refined
3.0
R
Active
100
73
Gi/o
αi1
-
62
-
scFv16
JMV449
peptide
Agonist
large neuromedin N, neurotensin, neuromedin N, large neurotensin
peptide
Yes
No
Kato HE, Zhang Y, Hu H, Suomivuori CM, Kadji FMN, Aoki J, Krishna Kumar K, Fonseca R, Hilger D, Huang W, Latorraca NR, Inoue A, Dror RO, Kobilka BK, Skiniotis G
10.1038/S41586-019-1337-6
2019-07-10
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
6QNO
6QNO_refined
4.4
R
Active
100
96
Gi/o
αi1
-
60
-
Fab antibody fragment light chain Fab antibody fragment heavy chain
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Tsai CJ, Marino J, Adaixo R, Pamula F, Muehle J, Maeda S, Flock T, Taylor NM, Mohammed I, Matile H, Dawson RJ, Deupi X, Stahlberg H, Schertler G
10.7554/ELIFE.46041
2019-07-10
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
6OY9
6OY9_refined
3.9
R
Active
100
94
Gi/o
αt1
-
64
-
-
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Gao Y, Hu H, Ramachandran S, Erickson JW, Cerione RA, Skiniotis G
10.1016/J.MOLCEL.2019.06.007
2019-07-24
Yes
SUCR1
succinate
Succinate
A
Rat
X-ray
6IBB
6IBB_refined
2.1
A
Intermediate
42
93
-
-
-
-
-
Nanobody-6
-
-
-
-
-
Yes
No
Haffke M, Fehlmann D, Rummel G, Boivineau J, Duckely M, Gommermann N, Cotesta S, Sirockin F, Freuler F, Littlewood-Evans A, Kaupmann K, Jaakola VP
10.1038/S41586-019-1663-8
2019-08-14
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
6OFJ
6OFJ_refined
4.5
A
Inactive
22
93
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhao DY, Poge M, Morizumi T, Gulati S, Van Eps N, Zhang J, Miszta P, Filipek S, Mahamid J, Plitzko JM, Baumeister W, Ernst OP, Palczewski K
10.1074/JBC.RA119.010089
2019-08-21
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
6KQI
6KQI_refined
3.3
A
Inactive
9
60
-
-
-
-
GlgA glycogen synthase
-
CP55940
Org27569
small-molecule small-molecule
Agonist NAM
anandamide, 2-arachidonoylglycerol
small-molecule
No
No
Shao Z, Yan W, Chapman K, Ramesh K, Ferrell AJ, Yin J, Wang X, Xu Q, Rosenbaum DM
10.1038/S41589-019-0387-2
2019-10-23
Yes
CLTR1
CysLT1
Leukotriene
A
Human
X-ray
6RZ4
6RZ4_refined
2.7
A
Intermediate
42
85
-
-
-
-
BRIL
-
pranlukast
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
Yes
Yes
Luginina A, Gusach A, Marin E, Mishin A, Brouillette R, Popov P, Shiriaeva A, Besserer-Offroy E, Longpre JM, Lyapina E, Ishchenko A, Patel N, Polovinkin V, Safronova N, Bogorodskiy A, Edelweiss E, Hu H, Weierstall U, Liu W, Batyuk A, Gordeliy V, Han GW, Sarret P, Katritch V, Borshchevskiy V, Cherezov V
10.1126/SCIADV.AAX2518
2019-10-30
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
6KJV
6KJV_refined
2.8
B
Inactive
0
57
-
-
-
-
T4-Lysozyme
-
PF-06372222
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Xu Y, Wang Y, Wang Y, Liu K, Peng Y, Yao D, Tao H, Liu H, Song G
10.1107/S2052252519013496
2019-11-13
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
6KK7
6KK7_refined
3.1
B
Inactive
0
56
-
-
-
-
T4-Lysozyme
-
PF-06372222
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Xu Y, Wang Y, Wang Y, Liu K, Peng Y, Yao D, Tao H, Liu H, Song G
10.1107/S2052252519013496
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS0
6PS0_refined
3.4
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
carazolol
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS2
6PS2_refined
2.4
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
CHEMBL1160734
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS4
6PS4_refined
2.6
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
CHEMBL1233766
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6PS6
6PS6_refined
2.7
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
timolol
small-molecule
Antagonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
MTR1A
MT1
Melatonin
A
Human
X-ray
6PS8
6PS8_refined
3.3
A
Inactive
1
83
-
-
-
-
GlgA glycogen synthase
-
2-phenylmelatonin
small-molecule
Agonist
melatonin
small-molecule
No
No
Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V
10.1107/S2052252519013137
2019-11-13
Yes
DRD4
D4
Dopamine
A
Mouse
X-ray
6IQL
6IQL_refined
3.5
A
Inactive
14
65
-
-
-
-
BRIL
-
L745870
small-molecule
Antagonist
-
-
Yes
No
Zhou Y, Cao C, He L, Wang X, Zhang XC
10.7554/ELIFE.48822
2019-12-04
Yes
ADA2C
α2C
Adrenoceptors
A
Human
X-ray
6KUW
6KUW_refined
2.8
A
Inactive
1
60
-
-
-
-
GlgA glycogen synthase
-
(8Ar,12aS,13aR)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine
small-molecule
Antagonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2019-12-04
Yes
NTR1
NTS1
Neurotensin
A
Human
cryo-EM
6PWC
6PWC_refined
4.9
R
Active
100
77
Beta
Beta-arrestin-1
-
84
-
Fab30 heavy chain Fab30 light chain
CHEMBL48981
protein
Agonist
large neuromedin N, neurotensin, neuromedin N, large neurotensin
peptide
Yes
No
Yin W, Li Z, Jin M, Yin YL, de Waal PW, Pal K, Yin Y, Gao X, He Y, Gao J, Wang X, Zhang Y, Zhou H, Melcher K, Jiang Y, Cong Y, Edward Zhou X, Yu X, Eric Xu H
10.1038/S41422-019-0256-2
2019-12-04
Yes
OPRD
δ
Opioid
A
Human
X-ray
6PT2
6PT2_refined
2.8
A
Active
74
78
-
-
-
-
BRIL
-
KGCHM07
peptide
Agonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
No
No
Claff T, Yu J, Blais V, Patel N, Martin C, Wu L, Han GW, Holleran BJ, Van der Poorten O, White KL, Hanson MA, Sarret P, Gendron L, Cherezov V, Katritch V, Ballet S, Liu ZJ, Muller CE, Stevens RC
10.1126/SCIADV.AAX9115
2019-12-11
Yes
CLTR2
CysLT2
Leukotriene
A
Human
X-ray
6RZ7
6RZ7_refined
2.4
A
Intermediate
42
79
-
-
-
-
BRIL
-
ONO-2570366
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
No
No
Gusach A, Luginina A, Marin E, Brouillette RL, Besserer-Offroy E, Longpre JM, Ishchenko A, Popov P, Patel N, Fujimoto T, Maruyama T, Stauch B, Ergasheva M, Romanovskaia D, Stepko A, Kovalev K, Shevtsov M, Gordeliy V, Han GW, Katritch V, Borshchevskiy V, Sarret P, Mishin A, Cherezov V
10.1038/S41467-019-13348-2
2019-12-11
Yes
CLTR2
CysLT2
Leukotriene
A
Human
X-ray
6RZ9
6RZ9_refined
2.7
A
Intermediate
42
81
-
-
-
-
BRIL
-
ONO-2770372
small-molecule
Antagonist
LTC4 , LTE4 , LTD4
small-molecule
No
No
Gusach A, Luginina A, Marin E, Brouillette RL, Besserer-Offroy E, Longpre JM, Ishchenko A, Popov P, Patel N, Fujimoto T, Maruyama T, Stauch B, Ergasheva M, Romanovskaia D, Stepko A, Kovalev K, Shevtsov M, Gordeliy V, Han GW, Katritch V, Borshchevskiy V, Sarret P, Mishin A, Cherezov V
10.1038/S41467-019-13348-2
2019-12-11
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TOD
-
2.1
A
Inactive
1
71
-
-
-
-
-
-
EMPA
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TP4
-
3.0
A
Inactive
1
70
-
-
-
-
-
-
ACT-462206
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX2R
OX2
Orexin
A
Human
X-ray
6TPG
6TPG_refined
2.7
A
Inactive
1
69
-
-
-
-
GlgA glycogen synthase
-
EMPA
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX2R
OX2
Orexin
A
Human
X-ray
6TPJ
6TPJ_refined
2.7
A
Inactive
1
68
-
-
-
-
GlgA glycogen synthase
-
suvorexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TQ6
6TQ6_refined
2.6
B
Inactive
1
71
-
-
-
-
-
-
CHEMBL4592653
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TQ9
6TQ9_refined
2.7
B
Inactive
1
71
-
-
-
-
-
-
SB-408124
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
6JOD
6JOD_refined
3.2
A
Active
100
84
-
-
-
-
BRIL
Heavy chain of 4A03Fab Light chain of 4A03Fab
angiotensin II
peptide
Agonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Asada H, Inoue A, Ngako Kadji FM, Hirata K, Shiimura Y, Im D, Shimamura T, Nomura N, Iwanari H, Hamakubo T, Kusano-Arai O, Hisano H, Uemura T, Suno C, Aoki J, Iwata S
10.1016/J.STR.2019.12.003
2020-01-15
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TOT
6TOT_refined
2.2
B
Inactive
1
71
-
-
-
-
-
-
lemborexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-15
Yes
APJ
apelin
Apelin
A
Human
X-ray
6KNM
6KNM_refined
3.2
B
Inactive
3
78
-
-
-
-
Rubredoxin
-
Single domain antibody JN241
protein
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Ma Y, Ding Y, Song X, Ma X, Li X, Zhang N, Song Y, Sun Y, Shen Y, Zhong W, Hu LA, Ma Y, Zhang MY
10.1126/SCIADV.AAX7379
2020-01-29
Yes
CNR2
CB2
Cannabinoid
A
Human
X-ray
6KPC
6KPC_refined
3.2
A
Inactive
9
79
-
-
-
-
T4-Lysozyme
-
7-[(6aR,9R,10aR)-1-Hydroxy-9-(hydroxymethyl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-3-yl]-7-methyloctanenitrile
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Li X, Wu L, Iliopoulos-Tsoutsouvas C, Wang Y, Wu M, Shen L, Brust CA, Nikas SP, Song F, Song X, Yuan S, Sun Q, Wu Y, Jiang S, Grim TW, Benchama O, Stahl EL, Zvonok N, Zhao S, Bohn LM, Makriyannis A, Liu ZJ
10.1016/J.CELL.2020.01.008
2020-02-12
Yes
CNR1
CB1
Cannabinoid
A
Human
cryo-EM
6KPG
6KPG_refined
3.0
R
Active
100
60
Gi/o
αi1
-
64
-
scFv16
AM841
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Li X, Wu L, Iliopoulos-Tsoutsouvas C, Wang Y, Wu M, Shen L, Brust CA, Nikas SP, Song F, Song X, Yuan S, Sun Q, Wu Y, Jiang S, Grim TW, Benchama O, Stahl EL, Zvonok N, Zhao S, Bohn LM, Makriyannis A, Liu ZJ
10.1016/J.CELL.2020.01.008
2020-02-12
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6NWE
6NWE_refined
2.7
A
Active
100
94
Gi/o
αt1
Only H5
3
-
-
B-Octylglucoside
small-molecule
unknown
-
-
No
No
-
-
2020-02-12
Yes
CRFR2
CRF2
Corticotropin-releasing factor
B1
Human
cryo-EM
6PB1
6PB1_refined
2.8
P
Active
100
68
Gs
αs
-
58
-
Nanobody-35
Urocortin
peptide
Agonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2, urocortin 3
peptide
No
No
Ma S, Shen Q, Zhao LH, Mao C, Zhou XE, Shen DD, de Waal PW, Bi P, Li C, Jiang Y, Wang MW, Sexton PM, Wootten D, Melcher K, Zhang Y, Xu HE
10.1016/J.MOLCEL.2020.01.013
2020-02-12
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
6OS0
6OS0_refined
2.9
A
Active
94
85
-
-
-
-
BRIL
Nanobody-Nb.AT110i1
angiotensin II
peptide
Agonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Wingler LM, Skiba MA, McMahon C, Staus DP, Kleinhenz ALW, Suomivuori CM, Latorraca NR, Dror RO, Lefkowitz RJ, Kruse AC
10.1126/SCIENCE.AAY9813
2020-02-19
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
6OS1
-
2.8
A
Active
94
85
-
-
-
-
BRIL
Nanobody-Nb.AT110i1_le
TRV023
peptide
Agonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Wingler LM, Skiba MA, McMahon C, Staus DP, Kleinhenz ALW, Suomivuori CM, Latorraca NR, Dror RO, Lefkowitz RJ, Kruse AC
10.1126/SCIENCE.AAY9813
2020-02-19
Yes
GPR52
GPR52
A orphans
A
Human
X-ray
6LI0
6LI0_refined
2.2
A
Inactive
38
81
-
-
-
-
Flavodoxin
-
derivative 17 [Nakahata et al ., 2018]
small-molecule
Agonist
-
-
Yes
No
Lin X, Li M, Wang N, Wu Y, Luo Z, Guo S, Han GW, Li S, Yue Y, Wei X, Xie X, Chen Y, Zhao S, Wu J, Lei M, Xu F
10.1038/S41586-020-2019-0
2020-02-26
Yes
GPR52
GPR52
A orphans
A
Human
cryo-EM
6LI3
6LI3_refined
3.3
R
Active
100
79
Gs
αs
Mini-Gs
61
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Lin X, Li M, Wang N, Wu Y, Luo Z, Guo S, Han GW, Li S, Yue Y, Wei X, Xie X, Chen Y, Zhao S, Wu J, Lei M, Xu F
10.1038/S41586-020-2019-0
2020-02-26
Yes
ACM2
M2
Acetylcholine (muscarinic)
A
Human
cryo-EM
6U1N
6U1N_refined
4.0
R
Active
100
57
Beta
Beta-arrestin-1
-
86
-
Fab30 light chain Fab30 heavy chain
LY2119620
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Staus DP, Hu H, Robertson MJ, Kleinhenz ALW, Wingler LM, Capel WD, Latorraca NR, Lefkowitz RJ, Skiniotis G
10.1038/S41586-020-1954-0
2020-02-26
Yes
NTR1
NTS1
Neurotensin
A
Human
cryo-EM
6UP7
6UP7_refined
4.2
R
Active
100
77
Beta
Beta-arrestin-1
-
83
-
-
JMV431
peptide
Agonist
large neuromedin N, neurotensin, neuromedin N, large neurotensin
peptide
Yes
No
Huang W, Masureel M, Qu Q, Janetzko J, Inoue A, Kato HE, Robertson MJ, Nguyen KC, Glenn JS, Skiniotis G, Kobilka BK
10.1038/S41586-020-1953-1
2020-02-26
Yes
PACR
PAC1
VIP and PACAP
B1
Human
cryo-EM
6LPB
6LPB_refined
3.9
R
Active
100
71
Gs
αs
-
57
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, PHI, PACAP-38, VIP, PHV
peptide
No
No
Kobayashi K, Shihoya W, Nishizawa T, Kadji FMN, Aoki J, Inoue A, Nureki O
10.1038/S41594-020-0386-8
2020-03-11
Yes
PACR
PAC1
VIP and PACAP
B1
Human
cryo-EM
6M1I
6M1I_refined
3.5
A
Active
100
75
Gs
αs
-
56
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, PHI, PACAP-38, VIP, PHV
peptide
No
No
Wang J, Song X, Zhang D, Chen X, Li X, Sun Y, Li C, Song Y, Ding Y, Ren R, Harrington EH, Hu LA, Zhong W, Xu C, Huang X, Wang HW, Ma Y
10.1038/S41422-020-0280-2
2020-03-11
Yes
OPRK
κ
Opioid
A
Human
X-ray
6VI4
6VI4_refined
3.3
B
Inactive
3
73
-
-
-
-
-
Nanobody-6
JDTic
small-molecule
Antagonist
big dynorphin, β-neoendorphin, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Che T, English J, Krumm BE, Kim K, Pardon E, Olsen RHJ, Wang S, Zhang S, Diberto JF, Sciaky N, Carroll FI, Steyaert J, Wacker D, Roth BL
10.1038/S41467-020-14889-7
2020-03-18
Yes
ADRB2
β2
Adrenoceptors
A
Human
X-ray
6OBA
6OBA_refined
3.1
A
Inactive
0
68
-
-
-
-
T4-Lysozyme
-
CHEMBL1160734
AS408
small-molecule small-molecule
Antagonist NAM
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
-
-
2020-03-25
Yes
GLR
glucagon
Glucagon
B1
Human
cryo-EM
6LMK
6LMK_refined
3.7
R
Active
100
83
Gs
αs
-
59
-
Nanobody-35
glucagon
peptide
Agonist
glucagon
peptide
No
No
Qiao A, Han S, Li X, Li Z, Zhao P, Dai A, Chang R, Tai L, Tan Q, Chu X, Ma L, Thorsen TS, Reedtz-Runge S, Yang D, Wang MW, Sexton PM, Wootten D, Sun F, Zhao Q, Wu B
10.1126/SCIENCE.AAZ5346
2020-04-01
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
6UUS
6UUS_refined
2.4
R
Active
100
74
Gs
αs
-
48
-
Nanobody-35 RAMP3
Adrenomedullin
peptide
Agonist
-
-
No
No
-
-
2020-04-01
Yes
ADA2B
α2B
Adrenoceptors
A
Human
cryo-EM
6K41
-
2.9
R
Active
100
54
Gi/o
αo
-
60
T4-Lysozyme
scFv
dexmedetomidine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Yuan D, Liu Z, Kaindl J, Maeda S, Zhao J, Sun X, Xu J, Gmeiner P, Wang HW, Kobilka BK
10.1038/S41589-020-0492-2
2020-04-15
Yes
ADA2B
α2B
Adrenoceptors
A
Human
cryo-EM
6K42
-
4.1
R
Active
100
60
Gi/o
αi1
-
62
T4-Lysozyme
scFv
dexmedetomidine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Yuan D, Liu Z, Kaindl J, Maeda S, Zhao J, Sun X, Xu J, Gmeiner P, Wang HW, Kobilka BK
10.1038/S41589-020-0492-2
2020-04-15
Yes
MC4R
MC4
Melanocortin
A
Human
X-ray
6W25
-
2.8
A
Intermediate
46
79
-
-
-
-
GlgA glycogen synthase
-
SHU9119
Calcium
peptide small-molecule
Antagonist Cofactor
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
Yu J, Gimenez LE, Hernandez CC, Wu Y, Wein AH, Han GW, McClary K, Mittal SR, Burdsall K, Stauch B, Wu L, Stevens SN, Peisley A, Williams SY, Chen V, Millhauser GL, Zhao S, Cone RD, Stevens RC
10.1126/SCIENCE.AAZ8995
2020-04-29
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6UO8
-
3.6
B
Active
-
74
-
-
-
-
-
-
CHEMBL112710
GS39783
small-molecule small-molecule
Agonist PAM
-
-
No
No
Shaye H, Ishchenko A, Lam JH, Han GW, Xue L, Rondard P, Pin JP, Katritch V, Gati C, Cherezov V
10.1038/S41586-020-2408-4
2020-06-10
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6UO9
-
4.8
B
Intermediate
-
73
-
-
-
-
-
-
CHEMBL112710
small-molecule
Agonist
-
-
No
No
Shaye H, Ishchenko A, Lam JH, Han GW, Xue L, Rondard P, Pin JP, Katritch V, Gati C, Cherezov V
10.1038/S41586-020-2408-4
2020-06-10
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
6TKO
6TKO_refined
3.3
A
Active
100
58
Beta
Beta-arrestin-1
-
82
-
Fab30 heavy chain Fab30 light chain
arformoterol
small-molecule
Agonist
-
-
Yes
No
Lee Y, Warne T, Nehme R, Pandey S, Dwivedi-Agnihotri H, Chaturvedi M, Edwards PC, Garcia-Nafria J, Leslie AGW, Shukla AK, Tate CG
10.1038/S41586-020-2419-1
2020-06-17
Yes
DRD2
D2
Dopamine
A
Human
cryo-EM
6VMS
6VMS_refined
3.8
R
Active
100
63
Gi/o
αi1
-
64
T4-Lysozyme
scFv16
bromocriptine
small-molecule
Agonist
dopamine
small-molecule
Yes
No
Yin J, Chen KM, Clark MJ, Hijazi M, Kumari P, Bai XC, Sunahara RK, Barth P, Rosenbaum DM
10.1038/S41586-020-2379-5
2020-06-17
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6PGS
6PGS_refined
2.9
A
Active
100
94
Gi/o
αt2
Only H5
3
-
-
Geraniol
small-molecule
unknown
-
-
No
No
-
-
2020-07-01
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6PH7
6PH7_refined
2.9
A
Active
100
94
Gi/o
αt2
Only H5
3
-
-
Nerol
small-molecule
unknown
-
-
No
No
-
-
2020-07-01
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6W2X
-
3.6
B
Inactive
-
71
-
-
-
-
-
-
CGP55845
1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine
small-molecule small-molecule
Inverse agonist NAM
-
-
No
No
Papasergi-Scott MM, Robertson MJ, Seven AB, Panova O, Mathiesen JM, Skiniotis G
10.1038/S41586-020-2469-4
2020-07-01
Yes
GABR1
GABAB1
GABAB
C
Human
cryo-EM
6W2Y
-
3.2
B
Inactive
-
69
-
-
-
-
-
-
CGP55845
1-Stearoyl-2-oleoyl-sn-glycero-3-phosphoethanolamine
small-molecule small-molecule
Inverse agonist NAM
GABA
small-molecule
No
No
Papasergi-Scott MM, Robertson MJ, Seven AB, Panova O, Mathiesen JM, Skiniotis G
10.1038/S41586-020-2469-4
2020-07-01
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7C7S
-
2.9
B
Inactive
-
71
-
-
-
-
-
-
CGP 54626A
small-molecule
Antagonist
-
-
No
No
Mao C, Shen C, Li C, Shen DD, Xu C, Zhang S, Zhou R, Shen Q, Chen LN, Jiang Z, Liu J, Zhang Y
10.1038/S41422-020-0350-5
2020-07-01
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6VCB
6VCB_refined
3.3
R
Active
100
82
Gs
αs
-
57
-
Nanobody-35
glucagon-like peptide 1-(7-37)
LSN3160440
peptide small-molecule
Agonist PAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Bueno AB, Sun B, Willard FS, Feng D, Ho JD, Wainscott DB, Showalter AD, Vieth M, Chen Q, Stutsman C, Chau B, Ficorilli J, Agejas FJ, Cumming GR, Jimenez A, Rojo I, Kobilka TS, Kobilka BK, Sloop KW
10.1038/S41589-020-0589-7
2020-07-22
Yes
SCTR
secretin
Glucagon
B1
Human
cryo-EM
6WZG
6WZG_refined
2.3
R
Active
100
86
Gs
αs
-
61
-
Nanobody-35
SECRETIN
protein
Agonist
secretin, VIP
peptide
No
No
Dong M, Deganutti G, Piper SJ, Liang YL, Khoshouei M, Belousoff MJ, Harikumar KG, Reynolds CA, Glukhova A, Furness SGB, Christopoulos A, Danev R, Wootten D, Sexton PM, Miller LJ
10.1038/S41467-020-17791-4
2020-08-12
Yes
CXCR2
CXCR2
Chemokine
A
Human
cryo-EM
6LFO
6LFO_refined
3.4
R
Active
100
85
Gi/o
αi1
-
65
-
scFv16
Interleukin-8
protein
Agonist
CXCL7, CXCL8, CXCL6, CXCL2, CXCL1, CXCL5, CXCL3
peptide
No
No
Liu K, Wu L, Yuan S, Wu M, Xu Y, Sun Q, Li S, Zhao S, Hua T, Liu ZJ
10.1038/S41586-020-2492-5
2020-09-02
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6X1A
6X1A_refined
2.5
R
Active
100
84
Gs
αs
-
89
-
Nanobody-35
danuglipron
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Singh N, Singh D, Bhide A, Sharma R, Bhowmick S, Patel V, Modi D
10.1101/2020.08.16.252585
2020-09-09
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6ZDV
6ZDV_refined
2.1
A
Inactive
1
72
-
-
-
-
BRIL
-
2-Methyl-3-(4-methylthiazol-2-yl)-4-oxo-6-propyl-4H-chromen-7-yl acetate
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Jespers W, Verdon G, Azuaje J, Majellaro M, Keranen H, Garcia-Mera X, Congreve M, Deflorian F, de Graaf C, Zhukov A, Dore AS, Mason JS, Aqvist J, Cooke RM, Sotelo E, Gutierrez-de-Teran H
10.1002/ANIE.202003788
2020-09-16
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
cryo-EM
6WHA
6WHA_refined
3.4
A
Active
100
52
Gq/11
αq
Gq-Gi2-Gs chimera
59
BRIL
scFv16
25-CN-NBOH
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
Yes
No
Kim K, Che T, Panova O, DiBerto JF, Lyu J, Krumm BE, Wacker D, Robertson MJ, Seven AB, Nichols DE, Shoichet BK, Skiniotis G, Roth BL
10.1016/J.CELL.2020.08.024
2020-09-23
Yes
SMO
SMO
Frizzled
F
Human
cryo-EM
6XBK
6XBK_refined
3.2
R
Active
100
59
Gi/o
αi1
-
61
-
scFv16
Cholesterol
small-molecule
Agonist
-
-
No
No
Qi X, Friedberg L, De Bose-Boyd R, Long T, Li X
10.1038/S41589-020-0646-2
2020-09-30
Yes
GNRHR
GnRH1
Gonadotrophin-releasing hormone
A
Human
X-ray
7BR3
7BR3_refined
2.8
A
Inactive
34
84
-
-
-
-
GlgA glycogen synthase
-
elagolix
small-molecule
Antagonist
GnRH II, GnRH I
peptide
No
No
-
-
2020-10-07
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7CA3
-
4.5
B
Active
-
72
-
-
-
-
-
-
BHFF
small-molecule
PAM
-
-
No
No
Kim Y, Jeong E, Jeong JH, Kim Y, Cho Y
10.1016/J.JMB.2020.09.023
2020-11-11
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7CA5
-
7.6
B
Inactive
-
70
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Kim Y, Jeong E, Jeong JH, Kim Y, Cho Y
10.1016/J.JMB.2020.09.023
2020-11-11
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6WQA
6WQA_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Lee MY, Geiger J, Ishchenko A, Han GW, Barty A, White TA, Gati C, Batyuk A, Hunter MS, Aquila A, Boutet S, Weierstall U, Cherezov V, Liu W
10.1107/S2052252520012701
2020-11-18
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6XOX
6XOX_refined
3.1
R
Active
100
82
Gs
αs
-
56
-
scFv16 Nanobody-35
LY3502970
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
-
-
2020-11-18
Yes
GHRHR
GHRH
Glucagon
B1
Human
cryo-EM
7CZ5
7CZ5_refined
2.6
R
Active
100
64
Gs
αs
-
58
-
Nanobody-35
Somatoliberin
peptide
Agonist
GHRH
peptide
No
No
Zhou F, Zhang H, Cong Z, Zhao LH, Zhou Q, Mao C, Cheng X, Shen DD, Cai X, Ma C, Wang Y, Dai A, Zhou Y, Sun W, Zhao F, Zhao S, Jiang H, Jiang Y, Yang D, Eric Xu H, Zhang Y, Wang MW
10.1038/S41467-020-18945-0
2020-11-18
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6LPK
6LPK_refined
1.8
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Ihara K, Hato M, Nakane T, Yamashita K, Kimura-Someya T, Hosaka T, Ishizuka-Katsura Y, Tanaka R, Tanaka T, Sugahara M, Hirata K, Yamamoto M, Nureki O, Tono K, Nango E, Iwata S, Shirouzu M
10.1038/S41598-020-76277-X
2020-11-25
Yes
ADRB1
β1
Adrenoceptors
A
Human
X-ray
7BTS
7BTS_refined
3.1
A
Active
100
58
-
-
-
-
T4-Lysozyme
Camelid antibody fragment Nb6B9
(-)-adrenaline
small-molecule
Agonist
noradrenaline, L-NOREPINEPHRINE, (-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Xu X, Kaindl J, Clark MJ, Hubner H, Hirata K, Sunahara RK, Gmeiner P, Kobilka BK, Liu X
10.1038/S41422-020-00424-2
2020-12-02
Yes
ADRB1
β1
Adrenoceptors
A
Human
X-ray
7BU7
7BU7_refined
2.6
A
Active
100
58
-
-
-
-
T4-Lysozyme
Camelid antibody fragment Nb6B9
CHEMBL1615159
small-molecule
Agonist
noradrenaline, L-NOREPINEPHRINE, (-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Xu X, Kaindl J, Clark MJ, Hubner H, Hirata K, Sunahara RK, Gmeiner P, Kobilka BK, Liu X
10.1038/S41422-020-00424-2
2020-12-02
Yes
STE2
STE2
STE2
D1
strain ATCC 204508 / S288c
cryo-EM
7AD3
-
3.5
A
Active
-
69
GPa1 family
αPa1
Two alpha subunits bound to STE2 dimer
46
-
-
Alpha-factor mating pheromone
peptide
Agonist
-
-
No
No
Velazhahan V, Ma N, Pandy-Szekeres G, Kooistra AJ, Lee Y, Gloriam DE, Vaidehi N, Tate CG
10.1038/S41586-020-2994-1
2020-12-09
Yes
ADRB2
β2
Adrenoceptors
A
Human
cryo-EM
7DHI
7DHI_refined
3.3
R
Active
100
70
Gs
αs
-
55
-
Nanobody-35
levosalbutamol
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Deng X, Li N, Mguni D, Wang J, Yang Y
10.1093/NSR/NWAA284
2020-12-16
Yes
DRD2
D2
Dopamine
A
Human
X-ray
7DFP
7DFP_refined
3.1
A
Inactive
1
57
-
-
-
-
BRIL
Fab heavy chain Fab light chain
spiperone
small-molecule
Antagonist
dopamine
small-molecule
No
No
Im D, Inoue A, Fujiwara T, Nakane T, Yamanaka Y, Uemura T, Mori C, Shiimura Y, Kimura KT, Asada H, Nomura N, Tanaka T, Yamashita A, Nango E, Tono K, Kadji FMN, Aoki J, Iwata S, Shimamura T
10.1038/S41467-020-20221-0
2020-12-30
Yes
NTR1
NTS1
Neurotensin
A
Rat
cryo-EM
7L0Q
7L0Q_refined
4.3
C
Active
100
73
Gi/o
αi1
-
95
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
-
-
2021-01-06
Yes
NTR1
NTS1
Neurotensin
A
Rat
cryo-EM
7L0S
7L0S_refined
4.5
C
Active
100
73
Gi/o
αi1
Non-canonical conformation
95
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
-
-
2021-01-06
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7LCJ
7LCJ_refined
2.8
R
Active
98
84
-
-
-
-
-
-
danuglipron
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
-
-
2021-01-20
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7LCK
7LCK_refined
3.2
R
Active
98
84
-
-
-
-
-
-
danuglipron
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
-
-
2021-01-20
Yes
AGRG3
ADGRG3
ADGRG
B2
Human
cryo-EM
7D76
-
3.1
R
Active
100
48
Gi/o
αo
-
59
-
-
Beclomethasone
small-molecule
Agonist
-
-
No
No
Ping YQ, Mao C, Xiao P, Zhao RJ, Jiang Y, Yang Z, An WT, Shen DD, Yang F, Zhang H, Qu C, Shen Q, Tian C, Li ZJ, Li S, Wang GY, Tao X, Wen X, Zhong YN, Yang J, Yi F, Yu X, Xu HE, Zhang Y, Sun JP
10.1038/S41586-020-03083-W
2021-02-03
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6YVR
-
2.5
B
Inactive
2
83
-
-
-
-
DARPin D12
-
JMV431
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6Z66
-
3.2
A
Intermediate
14
80
-
-
-
-
DARPin D12
-
Apo (no ligand)
none
Apo (no ligand)
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6Z8N
-
2.8
A
Intermediate
14
80
-
-
-
-
DARPin D12
-
(2~{S})-4-methyl-2-[(1-quinolin-8-ylsulfonylindol-3-yl)carbonylamino]pentanoic acid
small-molecule
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6ZIN
-
2.6
A
Inactive
27
76
-
-
-
-
DARPin D12
-
meclinertant
small-molecule
Inverse agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
OX2R
OX2
Orexin
A
Human
cryo-EM
7L1V
7L1V_refined
3.0
R
Active
100
64
Gs
αs
Engineered G alpha
58
-
scFv16 Nanobody-51
compound 1 [PMID: 33547286]
small-molecule
Agonist
orexin-A, orexin-B
peptide
Yes
No
Hong C, Byrne NJ, Zamlynny B, Tummala S, Xiao L, Shipman JM, Partridge AT, Minnick C, Breslin MJ, Rudd MT, Stachel SJ, Rada VL, Kern JC, Armacost KA, Hollingsworth SA, O'Brien JA, Hall DL, McDonald TP, Strickland C, Brooun A, Soisson SM, Hollenstein K
10.1038/S41467-021-21087-6
2021-02-10
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7JV5
7JV5_refined
3.0
R
Active
100
63
Gs
αs
-
60
-
Nanobody-35
CHEMBL1160787
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Zhuang Y, Xu P, Mao C, Wang L, Krumm B, Zhou XE, Huang S, Liu H, Cheng X, Huang XP, Shen DD, Xu T, Liu YF, Wang Y, Guo J, Jiang Y, Jiang H, Melcher K, Roth BL, Zhang Y, Zhang C, Xu HE
10.1016/J.CELL.2021.01.027
2021-02-24
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7JVQ
7JVQ_refined
3.0
R
Active
100
64
Gs
αs
Engineered G alpha
60
-
Nanobody-35
apomorphine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Zhuang Y, Xu P, Mao C, Wang L, Krumm B, Zhou XE, Huang S, Liu H, Cheng X, Huang XP, Shen DD, Xu T, Liu YF, Wang Y, Guo J, Jiang Y, Jiang H, Melcher K, Roth BL, Zhang Y, Zhang C, Xu HE
10.1016/J.CELL.2021.01.027
2021-02-24
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
7KNT
7KNT_refined
3.2
R
Inactive
8
74
-
-
-
-
-
RAMP1
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Josephs TM, Belousoff MJ, Liang YL, Piper SJ, Cao J, Garama DJ, Leach K, Gregory KJ, Christopoulos A, Hay DL, Danev R, Wootten D, Sexton PM
10.1126/SCIENCE.ABF7258
2021-02-24
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
7KNU
7KNU_refined
3.5
R
Inactive
8
74
-
-
-
-
-
RAMP1
Calcitonin gene-related peptide 1
peptide
Agonist
-
-
No
No
Josephs TM, Belousoff MJ, Liang YL, Piper SJ, Cao J, Garama DJ, Leach K, Gregory KJ, Christopoulos A, Hay DL, Danev R, Wootten D, Sexton PM
10.1126/SCIENCE.ABF7258
2021-02-24
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7CKX
7CKX_refined
3.5
R
Active
100
61
Gs
αs
-
60
-
Nanobody-35
A77636
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Xiao P, Yan W, Gou L, Zhong YN, Kong L, Wu C, Wen X, Yuan Y, Cao S, Qu C, Yang X, Yang CC, Xia A, Hu Z, Zhang Q, He YH, Zhang DL, Zhang C, Hou GH, Liu H, Zhu L, Fu P, Yang S, Rosenbaum DM, Sun JP, Du Y, Zhang L, Yu X, Shao Z
10.1016/J.CELL.2021.01.028
2021-03-03
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7CKZ
7CKZ_refined
3.1
R
Active
100
62
Gs
αs
-
60
-
Nanobody-35
dopamine
LY3154207
small-molecule small-molecule
Agonist PAM
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Xiao P, Yan W, Gou L, Zhong YN, Kong L, Wu C, Wen X, Yuan Y, Cao S, Qu C, Yang X, Yang CC, Xia A, Hu Z, Zhang Q, He YH, Zhang DL, Zhang C, Hou GH, Liu H, Zhu L, Fu P, Yang S, Rosenbaum DM, Sun JP, Du Y, Zhang L, Yu X, Shao Z
10.1016/J.CELL.2021.01.028
2021-03-03
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7LJC
-
3.0
R
Active
100
63
Gs
αs
Engineered G alpha
58
-
Nanobody-35
CHEMBL1160787
LY3154207
small-molecule small-molecule
Agonist PAM
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Singh N, Singh D, Bhide A, Sharma R, Bhowmick S, Patel V, Modi D
10.1101/2021.02.07.430101
2021-03-03
Yes
DRD3
D3
Dopamine
A
Human
cryo-EM
7CMU
7CMU_refined
3.0
R
Active
100
68
Gi/o
αi1
-
64
BRIL
scFv16
pramipexole
small-molecule
Agonist
dopamine
small-molecule
Yes
No
Xu P, Huang S, Mao C, Krumm BE, Zhou XE, Tan Y, Huang XP, Liu Y, Shen DD, Jiang Y, Yu X, Jiang H, Melcher K, Roth BL, Cheng X, Zhang Y, Xu HE
10.1016/J.MOLCEL.2021.01.003
2021-03-10
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DTT
7DTT_refined
3.8
A
Active
-
72
-
-
-
-
-
-
Calcium
small-molecule
Agonist
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Ling S, Shi P, Liu S, Meng X, Zhou Y, Sun W, Chang S, Zhang X, Zhang L, Shi C, Sun D, Liu L, Tian C
10.1038/S41422-021-00474-0
2021-03-10
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DTV
7DTV_refined
3.5
A
Active
-
72
-
-
-
-
-
-
Calcium
L-tryptophan
small-molecule small-molecule
Agonist PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Ling S, Shi P, Liu S, Meng X, Zhou Y, Sun W, Chang S, Zhang X, Zhang L, Shi C, Sun D, Liu L, Tian C
10.1038/S41422-021-00474-0
2021-03-10
Yes
HRH1
H1
Histamine
A
Human
cryo-EM
7DFL
7DFL_refined
3.3
R
Active
100
56
Gq/11
αq
-
63
-
scFv16
histamine
small-molecule
Agonist
histamine
small-molecule
Yes
No
-
-
2021-03-31
Yes
5HT1A
5-HT1A
5-Hydroxytryptamine
A
Human
cryo-EM
7E2Y
7E2Y_refined
3.0
R
Active
100
65
Gi/o
αi1
-
62
-
-
5-hydroxytryptamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Xu P, Huang S, Zhang H, Mao C, Zhou XE, Cheng X, Simon IA, Shen DD, Yen HY, Robinson CV, Harpsoe K, Svensson B, Guo J, Jiang H, Gloriam DE, Melcher K, Jiang Y, Zhang Y, Xu HE
10.1038/S41586-021-03376-8
2021-04-14
Yes
5HT1E
5-HT1E
5-Hydroxytryptamine
A
Human
cryo-EM
7E33
7E33_refined
2.9
R
Active
100
70
Gi/o
αi1
-
61
-
scFv16
BRL-54443
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
Yes
No
Xu P, Huang S, Zhang H, Mao C, Zhou XE, Cheng X, Simon IA, Shen DD, Yen HY, Robinson CV, Harpsoe K, Svensson B, Guo J, Jiang H, Gloriam DE, Melcher K, Jiang Y, Zhang Y, Xu HE
10.1038/S41586-021-03376-8
2021-04-14
Yes
5HT1D
5-HT1D
5-Hydroxytryptamine
A
Human
cryo-EM
7E32
7E32_refined
2.9
R
Active
100
76
Gi/o
αi1
-
62
-
scFv16
5-hydroxytryptamine
small-molecule
Agonist
5-HT-moduline, 5-hydroxytryptamine
small-molecule
Yes
No
Xu P, Huang S, Zhang H, Mao C, Zhou XE, Cheng X, Simon IA, Shen DD, Yen HY, Robinson CV, Harpsoe K, Svensson B, Guo J, Jiang H, Gloriam DE, Melcher K, Jiang Y, Zhang Y, Xu HE
10.1038/S41586-021-03376-8
2021-04-21
Yes
PE2R2
EP2
Prostanoid
A
Human
cryo-EM
7CX2
7CX2_refined
2.8
R
Active
100
74
Gs
αs
-
58
-
Nanobody-35
PGE2
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Qu C, Mao C, Xiao P, Shen Q, Zhong YN, Yang F, Shen DD, Tao X, Zhang H, Yan X, Zhao RJ, He J, Guan Y, Zhang C, Hou G, Zhang PJ, Hou G, Li Z, Yu X, Chai RJ, Guan YF, Sun JP, Zhang Y
10.1126/SCIADV.ABF1268
2021-05-05
Yes
PE2R2
EP2
Prostanoid
A
Human
cryo-EM
7CX4
7CX4_refined
2.9
R
Active
100
74
Gs
αs
-
58
-
Nanobody-35
evatanepag
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Qu C, Mao C, Xiao P, Shen Q, Zhong YN, Yang F, Shen DD, Tao X, Zhang H, Yan X, Zhao RJ, He J, Guan Y, Zhang C, Hou G, Zhang PJ, Hou G, Li Z, Yu X, Chai RJ, Guan YF, Sun JP, Zhang Y
10.1126/SCIADV.ABF1268
2021-05-05
Yes
V2R
V2
Vasopressin and oxytocin
A
Human
cryo-EM
7KH0
7KH0_refined
2.8
R
Active
100
74
Gs
αs
-
58
-
scFv16 Nanobody-35
vasopressin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Wang L, Xu J, Cao S, Sun D, Liu H, Lu Q, Liu Z, Du Y, Zhang C
10.1038/S41422-021-00483-Z
2021-05-26
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7MBX
7MBX_refined
2.0
R
Active
100
68
Gs
αs
-
61
-
Nanobody-35
CHEMBL216166
protein
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
-
-
2021-05-26
Yes
V2R
V2
Vasopressin and oxytocin
A
Human
cryo-EM
7BB6
7BB6_refined
4.2
A
Active
100
73
Gs
αs
-
54
-
Nanobody-35
vasopressin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Bous J, Orcel H, Floquet N, Leyrat C, Lai-Kee-Him J, Gaibelet G, Ancelin A, Saint-Paul J, Trapani S, Louet M, Sounier R, Demene H, Granier S, Bron P, Mouillac B
10.1126/SCIADV.ABG5628
2021-06-02
Yes
S1PR3
S1P3
Lysophospholipid (S1P)
A
Human
X-ray
7C4S
7C4S_refined
3.2
A
Active
82
75
-
-
-
-
-
Fab light chain Fab heavy chain
sphingosine 1-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Maeda S, Shiimura Y, Asada H, Hirata K, Luo F, Nango E, Tanaka N, Toyomoto M, Inoue A, Aoki J, Iwata S, Hagiwara M
10.1126/SCIADV.ABF5325
2021-06-09
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DD6
-
3.2
B
Active
-
73
-
-
-
-
-
-
Calcium
L-tryptophan
small-molecule small-molecule
Agonist PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Wen T, Wang Z, Chen X, Ren Y, Lu X, Xing Y, Lu J, Chang S, Zhang X, Shen Y, Yang X
10.1126/SCIADV.ABG1483
2021-06-16
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DD7
-
3.2
B
Active
-
73
-
-
-
-
-
-
Calcium
L-tryptophan
evocalcet
small-molecule small-molecule small-molecule
Agonist PAM PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Wen T, Wang Z, Chen X, Ren Y, Lu X, Xing Y, Lu J, Chang S, Zhang X, Shen Y, Yang X
10.1126/SCIADV.ABG1483
2021-06-16
Yes
GRM4
mGlu4
Metabotropic glutamate
C
Human
cryo-EM
7E9H
7E9H_refined
4.0
R
Intermediate
-
84
Gi/o
αi3
-
63
-
scFv16
L-serine-O-phosphate
small-molecule
Agonist
L-serine-O-phosphate, L-glutamic acid
small-molecule
No
No
Lin S, Han S, Cai X, Tan Q, Zhou K, Wang D, Wang X, Du J, Yi C, Chu X, Dai A, Zhou Y, Chen Y, Zhou Y, Liu H, Liu J, Yang D, Wang MW, Zhao Q, Wu B
10.1038/S41586-021-03495-2
2021-06-23
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7EPB
7EPB_refined
3.1
B
Active
-
89
-
-
-
-
-
Anti-RON nanobody
eglumegad
small-molecule
Agonist
L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7EPD
7EPD_refined
3.9
A
Inactive
-
89
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
X-ray
7EPF
7EPF_refined
2.7
A
Inactive
-
28
-
-
-
-
Flavodoxin
-
(8~{R})-4-[2,4-Bis(fluoranyl)phenyl]-8-methyl-7-[(2-methylpyrazol-3-yl)methyl]-6,8-dihydro-5~{H}-1,7-naphthyridine-2-carboxamide
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7M3F
7M3F_refined
2.8
B
Active
-
75
-
-
-
-
-
-
Calcium
L-tryptophan
cinacalcet
small-molecule small-molecule small-molecule
Agonist PAM PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Gao Y, Robertson MJ, Rahman SN, Seven AB, Zhang C, Meyerowitz JG, Panova O, Hannan FM, Thakker RV, Brauner-Osborne H, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03691-0
2021-06-30
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7M3J
7M3J_refined
4.1
A
Inactive
-
72
-
-
-
-
-
-
NPS 2143
small-molecule
NAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Gao Y, Robertson MJ, Rahman SN, Seven AB, Zhang C, Meyerowitz JG, Panova O, Hannan FM, Thakker RV, Brauner-Osborne H, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03691-0
2021-06-30
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
7O7F
7O7F_refined
3.2
C
Active
100
85
Gi/o
αi1
-
62
-
Fab heavy chain Fab light chain
CCL5
peptide
Agonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Isaikina P, Tsai CJ, Dietz N, Pamula F, Grahl A, Goldie KN, Guixa-Gonzalez R, Branco C, Paolini-Bertrand M, Calo N, Cerini F, Schertler GFX, Hartley O, Stahlberg H, Maier T, Deupi X, Grzesiek S
10.1126/SCIADV.ABG8685
2021-06-30
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
7MTA
7MTA_refined
4.1
R
Active
97
93
-
-
-
-
-
Fab heavy chain Fab light chain GRK1
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Chen Q, Plasencia M, Li Z, Mukherjee S, Patra D, Chen CL, Klose T, Yao XQ, Kossiakoff AA, Chang L, Andrews PC, Tesmer JJG
10.1038/S41586-021-03721-X
2021-07-07
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7MTQ
-
3.7
B
Inactive
-
85
-
-
-
-
-
-
LY341495
small-molecule
Antagonist
L-glutamic acid
small-molecule
No
No
Seven AB, Barros-Alvarez X, de Lapeyriere M, Papasergi-Scott MM, Robertson MJ, Zhang C, Nwokonko RM, Gao Y, Meyerowitz JG, Rocher JP, Schelshorn D, Kobilka BK, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03680-3
2021-07-07
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7MTS
7MTS_refined
3.2
A
Active
-
90
Gi/o
αi1
-
58
-
-
2-methoxy-6-propyl-N-(2-{4-[(1H-tetrazol-5-yl)methoxy]phenyl}ethyl)thieno[2,3-d]pyrimidin-4-amine
L-glutamic acid
small-molecule small-molecule
Ago-PAM Agonist
L-glutamic acid
small-molecule
No
No
Seven AB, Barros-Alvarez X, de Lapeyriere M, Papasergi-Scott MM, Robertson MJ, Zhang C, Nwokonko RM, Gao Y, Meyerowitz JG, Rocher JP, Schelshorn D, Kobilka BK, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03680-3
2021-07-07
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
7F1Q
7F1Q_refined
2.9
R
Active
100
84
Gi/o
αi1
-
61
-
-
CCL3
peptide
Agonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Zhang H, Chen K, Tan Q, Shao Q, Han S, Zhang C, Yi C, Chu X, Zhu Y, Xu Y, Zhao Q, Wu B
10.1038/S41467-021-24438-5
2021-07-14
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7E6T
7E6T_refined
3.0
A
Active
-
74
-
-
-
-
-
-
Calcium
Cyclomethyltryptophan
small-molecule small-molecule
Agonist PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Chen X, Wang L, Cui Q, Ding Z, Han L, Kou Y, Zhang W, Wang H, Jia X, Dai M, Shi Z, Li Y, Li X, Geng Y
10.7554/ELIFE.68578
2021-09-22
Yes
S1PR5
S1P5
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW1
7EW1_refined
3.4
A
Active
100
68
Gi/o
αi1
-
64
-
scFv16
siponimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yuan Y, Jia G, Wu C, Wang W, Cheng L, Li Q, Li Z, Luo K, Yang S, Yan W, Su Z, Shao Z
10.1038/S41422-021-00566-X
2021-09-29
Yes
S1PR3
S1P3
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW3
-
3.1
R
Active
100
77
Gi/o
αi1
-
64
-
scFv16
Sphingosine 1-phosphate
lipid
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Zhao C, Cheng L, Wang W, Wang H, Luo Y, Feng Y, Wang X, Fu H, Cai Y, Yang S, Fu P, Yan W, Shao Z
10.1038/S41422-021-00567-W
2021-09-29
Yes
LSHR
LH
Glycoprotein hormone
A
Human
cryo-EM
7FIG
-
3.9
R
Active
100
79
Gs
αs
-
91
-
Nanobody-35
Choriogonadotropin beta
Glycoprotein alpha
protein protein
Agonist
LH, hCG
peptide
Yes
No
Duan J, Xu P, Cheng X, Mao C, Croll T, He X, Shi J, Luan X, Yin W, You E, Liu Q, Zhang S, Jiang H, Zhang Y, Jiang Y, Xu HE
10.1038/S41586-021-03924-2
2021-09-29
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TQ7
6TQ7_refined
2.7
A
Inactive
1
71
-
-
-
-
-
-
SB-334867
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-01
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6ORV
-
3.0
E
Active
100
61
Gs
αs
-
48
-
Nanobody-35
CHEMBL3950796
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhao P, Liang YL, Belousoff MJ, Deganutti G, Fletcher MM, Willard FS, Bell MG, Christe ME, Sloop KW, Inoue A, Truong TT, Clydesdale L, Furness SGB, Christopoulos A, Wang MW, Miller LJ, Reynolds CA, Danev R, Sexton PM, Wootten D
10.1038/s41586-019-1902-z
2020-01-08
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6TOS
6TOS_refined
2.1
B
Inactive
1
72
-
-
-
-
-
-
CHEMBL2413522
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA.
10.1021/acs.jmedchem.9b01787
2020-01-15
Yes
CRFR1
CRF1
Corticotropin-releasing factor
B1
Human
cryo-EM
6P9X
6P9X_refined
2.9
R
Active
100
65
Gs
αs
-
49
-
Nanobody-35
Corticoliberin
peptide
Agonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2
peptide
No
No
Liang YL, Belousoff MJ, Zhao P, Koole C, Fletcher MM, Truong TT, Julita V, Christopoulos G, Xu HE, Zhang Y, Khoshouei M, Christopoulos A, Danev R, Sexton PM, Wootten D
10.1016/J.MOLCEL.2020.01.012
2020-02-05
Yes
PACR
PAC1
VIP and PACAP
B1
Human
cryo-EM
6P9Y
6P9Y_refined
3.0
R
Active
100
55
Gs
αs
-
49
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, PHI, PACAP-38, VIP, PHV
peptide
No
No
-
-
2020-02-05
Yes
CNR2
CB2
Cannabinoid
A
Human
cryo-EM
6KPF
6KPF_refined
2.9
R
Active
100
81
Gi/o
αi1
-
62
-
scFv16
7-[(6aR,9R,10aR)-1-Hydroxy-9-(hydroxymethyl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromen-3-yl]-7-methyloctanenitrile
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Hua T, Li X, Wu L, Iliopoulos-Tsoutsouvas C, Wang Y, Wu M, Shen L, Brust CA, Nikas SP, Song F, Song X, Yuan S, Sun Q, Wu Y, Jiang S, Grim TW, Benchama O, Stahl EL, Zvonok N, Zhao S, Bohn LM, Makriyannis A, Liu ZJ
10.1016/J.CELL.2020.01.008
2020-02-12
Yes
EDNRB
ETB
Endothelin
A
Human
X-ray
6LRY
6LRY_refined
3.0
A
Inactive
14
70
-
-
-
-
T4-Lysozyme
-
sarafotoxin S6b
peptide
Agonist
endothelin-1, endothelin-2, endothelin-3
peptide
Yes
No
Izume T, Miyauchi H, Shihoya W, Nureki O
10.1016/J.BBRC.2019.12.091
2020-02-12
Yes
CRFR1
CRF1
Corticotropin-releasing factor
B1
Human
cryo-EM
6PB0
6PB0_refined
3.0
R
Active
100
68
Gs
αs
Gs-Gi1 chimera
58
-
Nanobody-35
Urocortin
peptide
Agonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2
peptide
No
No
Ma S, Shen Q, Zhao LH, Mao C, Zhou XE, Shen DD, de Waal PW, Bi P, Li C, Jiang Y, Wang MW, Sexton PM, Wootten D, Melcher K, Zhang Y, Xu HE
10.1016/J.MOLCEL.2020.01.013
2020-02-12
Yes
CNR2
CB2
Cannabinoid
A
Human
cryo-EM
6PT0
6PT0_refined
3.2
R
Active
100
83
Gi/o
αi1
-
100
-
scFv16
WIN55212-2
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Xing C, Zhuang Y, Xu TH, Feng Z, Zhou XE, Chen M, Wang L, Meng X, Xue Y, Wang J, Liu H, McGuire TF, Zhao G, Melcher K, Zhang C, Xu HE, Xie XQ
10.1016/J.CELL.2020.01.007
2020-02-12
Yes
AGTR1
AT1
Angiotensin
A
Human
X-ray
6OS2
-
2.7
A
Active
94
85
-
-
-
-
BRIL
Nanobody-Nb.AT110i1_le
TRV026
peptide
Agonist
angiotensin A, angiotensin IV, angiotensin II, angiotensin III
peptide
Yes
No
Wingler LM, Skiba MA, McMahon C, Staus DP, Kleinhenz ALW, Suomivuori CM, Latorraca NR, Dror RO, Lefkowitz RJ, Kruse AC
10.1126/SCIENCE.AAY9813
2020-02-19
Yes
GPR52
GPR52
A orphans
A
Human
X-ray
6LI1
6LI1_refined
2.9
A
Inactive
38
81
-
-
-
-
Flavodoxin
-
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Lin X, Li M, Wang N, Wu Y, Luo Z, Guo S, Han GW, Li S, Yue Y, Wei X, Xie X, Chen Y, Zhao S, Wu J, Lei M, Xu F
10.1038/S41586-020-2019-0
2020-02-26
Yes
GPR52
GPR52
A orphans
A
Human
X-ray
6LI2
6LI2_refined
2.8
A
Inactive
38
80
-
-
-
-
Rubredoxin
-
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Lin X, Li M, Wang N, Wu Y, Luo Z, Guo S, Han GW, Li S, Yue Y, Wei X, Xie X, Chen Y, Zhao S, Wu J, Lei M, Xu F
10.1038/S41586-020-2019-0
2020-02-26
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
6OMM
6OMM_refined
3.2
R
Active
100
85
Gi/o
αi1
-
61
-
-
CHEMBL552527
protein
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Zhuang Y, Liu H, Edward Zhou X, Kumar Verma R, de Waal PW, Jang W, Xu TH, Wang L, Meng X, Zhao G, Kang Y, Melcher K, Fan H, Lambert NA, Eric Xu H, Zhang C
10.1038/S41467-020-14728-9
2020-02-26
Yes
DRD2
D2
Dopamine
A
Human
X-ray
6LUQ
6LUQ_refined
3.1
A
Inactive
1
59
-
-
-
-
T4-Lysozyme
-
haloperidol
small-molecule
Antagonist
dopamine
small-molecule
Yes
No
Fan L, Tan L, Chen Z, Qi J, Nie F, Luo Z, Cheng J, Wang S
10.1038/S41467-020-14884-Y
2020-03-04
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
X-ray
6KP6
6KP6_refined
3.0
A
Inactive
3
59
-
-
-
-
GlgA glycogen synthase
-
Apo (no ligand)
none
Apo (no ligand)
acetylcholine
small-molecule
Yes
No
Wang J, Wu M, Wu L, Xu Y, Li F, Wu Y, Popov P, Wang L, Bai F, Zhao S, Liu ZJ, Hua T
10.1107/S2052252520000597
2020-03-11
Yes
PACR
PAC1
VIP and PACAP
B1
Human
cryo-EM
6M1H
6M1H_refined
3.6
A
Active
100
73
Gs
αs
-
54
-
Nanobody-35
maxadilan
peptide
Agonist
PACAP-27, PHM, PHI, PACAP-38, VIP, PHV
peptide
No
No
Wang J, Song X, Zhang D, Chen X, Li X, Sun Y, Li C, Song Y, Ding Y, Ren R, Harrington EH, Hu LA, Zhong W, Xu C, Huang X, Wang HW, Ma Y
10.1038/S41422-020-0280-2
2020-03-11
Yes
GLP1R
GLP-1
Glucagon
B1
Human
X-ray
6LN2
6LN2_refined
3.2
A
Inactive
0
83
-
-
-
-
-
Fab7F38 light chain Fab7F38 heavy chain
PF-06372222
small-molecule
NAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Wu F, Yang L, Hang K, Laursen M, Wu L, Han GW, Ren Q, Roed NK, Lin G, Hanson MA, Jiang H, Wang MW, Reedtz-Runge S, Song G, Stevens RC
10.1038/S41467-020-14934-5
2020-03-18
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
X-ray
6LW5
6LW5_refined
2.8
A
Active
100
91
-
-
-
-
BRIL
-
CHEMBL552527
protein
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Chen T, Xiong M, Zong X, Ge Y, Zhang H, Wang M, Won Han G, Yi C, Ma L, Ye RD, Xu Y, Zhao Q, Wu B
10.1038/S41467-020-15009-1
2020-03-25
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
6UUN
6UUN_refined
3.0
R
Active
100
77
Gs
αs
-
48
-
Nanobody-35 RAMP2
Adrenomedullin
peptide
Agonist
-
-
No
No
-
-
2020-03-25
Yes
GLR
glucagon
Glucagon
B1
Human
cryo-EM
6LML
6LML_refined
3.9
R
Active
100
83
Gi/o
αi1
-
63
-
scFv16
glucagon
peptide
Agonist
glucagon
peptide
No
No
Qiao A, Han S, Li X, Li Z, Zhao P, Dai A, Chang R, Tai L, Tan Q, Chu X, Ma L, Thorsen TS, Reedtz-Runge S, Yang D, Wang MW, Sexton PM, Wootten D, Sun F, Zhao Q, Wu B
10.1126/SCIENCE.AAZ5346
2020-04-01
Yes
CALRL
calcitonin-like
Calcitonin
B1
Human
cryo-EM
6UVA
6UVA_refined
2.3
R
Active
100
75
Gs
αs
-
48
-
Nanobody-35 RAMP3
adrenomedullin 2/intermedin
peptide
Agonist
-
-
No
No
-
-
2020-04-01
Yes
GLR
glucagon
Glucagon
B1
Human
cryo-EM
6WHC
6WHC_refined
3.4
R
Active
100
78
Gs
αs
-
56
-
Nanobody-35
Dual-agonist peptide P15
peptide
Agonist
glucagon
peptide
No
No
Chang R, Zhang X, Qiao A, Dai A, Belousoff MJ, Tan Q, Shao L, Zhong L, Lin G, Liang YL, Ma L, Han S, Yang D, Danev R, Wang MW, Wootten D, Wu B, Sexton PM
10.1074/JBC.RA120.013793
2020-05-27
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6UOA
-
6.3
B
Intermediate
-
71
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Shaye H, Ishchenko A, Lam JH, Han GW, Xue L, Rondard P, Pin JP, Katritch V, Gati C, Cherezov V
10.1038/S41586-020-2408-4
2020-06-10
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6VJM
-
4.0
B
Inactive
-
73
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Shaye H, Ishchenko A, Lam JH, Han GW, Xue L, Rondard P, Pin JP, Katritch V, Gati C, Cherezov V
10.1038/S41586-020-2408-4
2020-06-10
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
X-ray
6PEL
6PEL_refined
3.2
A
Active
100
93
Gi/o
αt1
Only H5
3
-
-
Citronellol
small-molecule
unknown
-
-
No
No
-
-
2020-06-24
Yes
CCR6
CCR6
Chemokine
A
Human
cryo-EM
6WWZ
6WWZ_refined
3.3
R
Active
100
83
Gi/o
αo
-
59
-
scFv16
CCL20
peptide
Agonist
beta-defensin 4A, CCL20
peptide
No
No
Wasilko DJ, Johnson ZL, Ammirati M, Che Y, Griffor MC, Han S, Wu H
10.1038/S41467-020-16820-6
2020-06-24
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
6WIV
-
3.3
B
Inactive
-
71
-
-
-
-
-
-
[(2R)-3-[(Z)-icos-11-enoyl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethylphosphate
(2R)-3-{[(S)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-{[(9Z)-octadec-9-enoyl]oxy}propyl(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate
small-molecule small-molecule
NAM
-
-
No
No
Park J, Fu Z, Frangaj A, Liu J, Mosyak L, Shen T, Slavkovich VN, Ray KM, Taura J, Cao B, Geng Y, Zuo H, Kou Y, Grassucci R, Chen S, Liu Z, Lin X, Williams JP, Rice WJ, Eng ET, Huang RK, Soni RK, Kloss B, Yu Z, Javitch JA, Hendrickson WA, Slesinger PA, Quick M, Graziano J, Yu H, Fiehn O, Clarke OB, Frank J, Fan QR
10.1038/S41586-020-2452-0
2020-07-01
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6S0L
6S0L_refined
2.7
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
-
-
2020-07-15
Yes
OX1R
OX1
Orexin
A
Human
X-ray
6V9S
6V9S_refined
3.5
A
Inactive
1
72
-
-
-
-
GlgA glycogen synthase
-
JH112
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Hellmann J, Drabek M, Yin J, Gunera J, Proll T, Kraus F, Langmead CJ, Hubner H, Weikert D, Kolb P, Rosenbaum DM, Gmeiner P
10.1073/PNAS.2002704117
2020-07-15
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
7C6A
7C6A_refined
3.4
A
Active
99
77
-
-
-
-
BRIL
IgG heavy chain IgG light chain
CHEMBL404594
protein
Agonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
Miyagi H, Asada H, Suzuki M, Takahashi Y, Yasunaga M, Suno C, Iwata S, Saito JI
10.1038/S41598-020-68355-X
2020-07-29
Yes
GHSR
ghrelin
Ghrelin
A
Human
X-ray
6KO5
6KO5_refined
3.3
A
Inactive
1
80
-
-
-
-
BRIL
Fab7881 heavy chain Fab7881 light chain
CHEMBL1956994
small-molecule
Antagonist
ghrelin, [des-Gln14 ]ghrelin
peptide
No
No
-
-
2020-08-12
Yes
FZD5
FZD5
Frizzled
F
Human
cryo-EM
6WW2
6WW2_refined
3.7
R
Inactive
22
55
-
-
-
-
BRIL
anti-BRIL Fab heavy chain anti-BRIL Fab light chain anti-Fab Nanobody
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Tsutsumi N, Mukherjee S, Waghray D, Janda CY, Jude KM, Miao Y, Burg JS, Aduri NG, Kossiakoff AA, Gati C, Garcia KC
10.7554/ELIFE.58464
2020-08-19
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7C2E
7C2E_refined
4.2
R
Active
100
82
Gs
αs
-
48
-
Nanobody-35
2-[[4-[6-[(4-cyano-2-fluoranyl-phenyl)methoxy]pyridin-2-yl]-3,6-dihydro-2~{H}-pyridin-1-yl]methyl]-3-[[(2~{S})-oxetan-2-yl]methyl]imidazo[4,5-b]pyridine-5-carboxylic acid
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Ma H, Huang W, Wang X, Zhao L, Jiang Y, Liu F, Guo W, Sun X, Zhong W, Yuan D, Xu HE
10.1038/S41422-020-0384-8
2020-08-26
Yes
GPBAR
GPBA
Bile acid
A
Human
cryo-EM
7BW0
7BW0_refined
3.9
R
Active
100
85
Gs
αs
-
56
BRIL
Nanobody-35
-
-
-
lithocholic acid, chenodeoxycholic acid, cholic acid, deoxycholic acid
small-molecule
No
No
Chen G, Wang X, Ge Y, Ma L, Chen Q, Liu H, Du Y, Ye RD, Hu H, Ren R
10.1038/S41392-020-00262-Z
2020-09-02
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
7JJO
7JJO_refined
2.6
R
Active
100
58
Gs
αs
-
51
-
Nanobody-35
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
Su M, Zhu L, Zhang Y, Paknejad N, Dey R, Huang J, Lee MY, Williams D, Jordan KD, Eng ET, Ernst OP, Meyerson JR, Hite RK, Walz T, Liu W, Huang XY
10.1016/J.MOLCEL.2020.08.001
2020-09-02
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
6X19
6X19_refined
2.1
R
Active
100
84
Gs
αs
-
89
-
Nanobody-35
CHU-128
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Singh N, Singh D, Bhide A, Sharma R, Bhowmick S, Patel V, Modi D
10.1101/2020.08.16.252585
2020-09-09
Yes
GPBAR
GPBA
Bile acid
A
Human
cryo-EM
7CFM
7CFM_refined
3.0
R
Active
100
83
Gs
αs
-
58
-
Nanobody-35
CHEMBL2331646
small-molecule
Agonist
lithocholic acid, chenodeoxycholic acid, cholic acid, deoxycholic acid
small-molecule
No
No
Yang F, Mao C, Guo L, Lin J, Ming Q, Xiao P, Wu X, Shen Q, Guo S, Shen DD, Lu R, Zhang L, Huang S, Ping Y, Zhang C, Ma C, Zhang K, Liang X, Shen Y, Nan F, Yi F, Luca VC, Zhou J, Jiang C, Sun JP, Xie X, Yu X, Zhang Y
10.1038/S41586-020-2569-1
2020-09-09
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6ZDR
6ZDR_refined
1.9
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL2030687
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Jespers W, Verdon G, Azuaje J, Majellaro M, Keranen H, Garcia-Mera X, Congreve M, Deflorian F, de Graaf C, Zhukov A, Dore AS, Mason JS, Aqvist J, Cooke RM, Sotelo E, Gutierrez-de-Teran H
10.1002/ANIE.202003788
2020-09-16
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
6WH4
6WH4_refined
3.4
C
Inactive
1
59
-
-
-
-
BRIL
-
CHEMBL428892
small-molecule
Inverse agonist
tryptamine, 5-hydroxytryptamine
small-molecule
Yes
No
Kim K, Che T, Panova O, DiBerto JF, Lyu J, Krumm BE, Wacker D, Robertson MJ, Seven AB, Nichols DE, Shoichet BK, Skiniotis G, Roth BL
10.1016/J.CELL.2020.08.024
2020-09-23
Yes
SMO
SMO
Frizzled
F
Human
cryo-EM
6XBL
6XBL_refined
3.9
R
Active
100
59
Gi/o
αi1
-
61
-
scFv16
Cholesterol
SAG1.3
small-molecule small-molecule
Agonist PAM
-
-
No
No
Qi X, Friedberg L, De Bose-Boyd R, Long T, Li X
10.1038/S41589-020-0646-2
2020-09-30
Yes
SCTR
secretin
Glucagon
B1
Human
cryo-EM
7D3S
7D3S_refined
2.9
R
Active
100
60
Gs
αs
-
58
-
Nanobody-35
SECRETIN
protein
Agonist
secretin, VIP
peptide
No
No
Fukuhara S, Kobayashi K, Kusakizako T, Iida W, Kato M, Shihoya W, Nureki O
10.1016/J.BBRC.2020.08.042
2020-11-04
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7CUM
-
3.5
B
Inactive
-
72
-
-
-
-
-
-
CGP 54626A
Unknown ligand
small-molecule none
Antagonist NAM
-
-
No
No
Kim Y, Jeong E, Jeong JH, Kim Y, Cho Y
10.1016/J.JMB.2020.09.023
2020-11-11
Yes
PE2R4
EP4
Prostanoid
A
Human
cryo-EM
7D7M
7D7M_refined
3.3
A
Active
100
58
Gs
αs
-
58
-
Nanobody-35
PGE2
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
No
No
-
-
2020-11-18
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6LPJ
6LPJ_refined
1.8
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Ihara K, Hato M, Nakane T, Yamashita K, Kimura-Someya T, Hosaka T, Ishizuka-Katsura Y, Tanaka R, Tanaka T, Sugahara M, Hirata K, Yamamoto M, Nureki O, Tono K, Nango E, Iwata S, Shirouzu M
10.1038/S41598-020-76277-X
2020-11-25
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
6LPL
6LPL_refined
2.0
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Ihara K, Hato M, Nakane T, Yamashita K, Kimura-Someya T, Hosaka T, Ishizuka-Katsura Y, Tanaka R, Tanaka T, Sugahara M, Hirata K, Yamamoto M, Nureki O, Tono K, Nango E, Iwata S, Shirouzu M
10.1038/S41598-020-76277-X
2020-11-25
Yes
ADRB1
β1
Adrenoceptors
A
Human
X-ray
7BU6
7BU6_refined
2.7
A
Active
100
58
-
-
-
-
T4-Lysozyme
Camelid antibody fragment Nb6B9
Noradrenaline
small-molecule
Agonist
noradrenaline, L-NOREPINEPHRINE, (-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Xu X, Kaindl J, Clark MJ, Hubner H, Hirata K, Sunahara RK, Gmeiner P, Kobilka BK, Liu X
10.1038/S41422-020-00424-2
2020-12-02
Yes
ADRB1
β1
Adrenoceptors
A
Human
X-ray
7BVQ
7BVQ_refined
2.5
A
Inactive
0
60
-
-
-
-
T4-Lysozyme
-
Carazolol
small-molecule
Inverse agonist
noradrenaline, L-NOREPINEPHRINE, (-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Xu X, Kaindl J, Clark MJ, Hubner H, Hirata K, Sunahara RK, Gmeiner P, Kobilka BK, Liu X
10.1038/S41422-020-00424-2
2020-12-02
Yes
GLP2R
GLP-2
Glucagon
B1
Human
cryo-EM
7D68
7D68_refined
3.0
R
Active
100
53
Gs
αs
-
57
-
Nanobody-35
glucagon
peptide
Agonist
glucagon-like peptide 2-(3-33), glucagon-like peptide 2
peptide
No
No
Sun W, Chen LN, Zhou Q, Zhao LH, Yang D, Zhang H, Cong Z, Shen DD, Zhao F, Zhou F, Cai X, Chen Y, Zhou Y, Gadgaard S, van der Velden WJC, Zhao S, Jiang Y, Rosenkilde MM, Xu HE, Zhang Y, Wang MW
10.1038/S41422-020-00442-0
2020-12-16
Yes
ADRB2
β2
Adrenoceptors
A
Human
cryo-EM
7DHR
7DHR_refined
3.8
R
Active
100
69
Gs
αs
-
49
-
Nanobody-35
LEVISOPRENALINE
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ , (-)-adrenaline
small-molecule
Yes
No
Deng X, Li N, Mguni D, Wang J, Yang Y
10.1093/NSR/NWAA284
2020-12-16
Yes
NTR1
NTS1
Neurotensin
A
Rat
cryo-EM
7L0P
7L0P_refined
4.1
C
Active
100
73
Gi/o
αi1
-
63
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
-
-
2021-01-06
Yes
NTR1
NTS1
Neurotensin
A
Rat
cryo-EM
7L0R
7L0R_refined
4.2
C
Active
100
73
Gi/o
αi1
Non-canonical conformation
63
-
-
neurotensin
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
-
-
2021-01-06
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7LCI
7LCI_refined
2.9
R
Active
100
85
Gs
αs
-
62
-
-
danuglipron
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
-
-
2021-01-20
Yes
NPY2R
Y2
Neuropeptide Y
A
Human
X-ray
7DDZ
7DDZ_refined
2.8
A
Inactive
1
76
-
-
-
-
Flavodoxin
-
CHEMBL1823578
small-molecule
Antagonist
neuropeptide Y-(3-36), PYY-(3-36), neuropeptide Y, peptide YY, pancreatic polypeptide
peptide
Yes
No
-
-
2021-01-27
Yes
AGRG3
ADGRG3
ADGRG
B2
Human
cryo-EM
7D77
7D77_refined
2.9
R
Active
100
48
Gi/o
αo
-
61
-
scFv16
HYDROCORTISONE
small-molecule
Agonist
-
-
No
No
Ping YQ, Mao C, Xiao P, Zhao RJ, Jiang Y, Yang Z, An WT, Shen DD, Yang F, Zhang H, Qu C, Shen Q, Tian C, Li ZJ, Li S, Wang GY, Tao X, Wen X, Zhong YN, Yang J, Yi F, Yu X, Xu HE, Zhang Y, Sun JP
10.1038/S41586-020-03083-W
2021-02-03
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6Z4Q
-
2.9
A
Inactive
27
75
-
-
-
-
DARPin D12
-
SR142948A
small-molecule
Inverse agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6Z4S
-
2.7
A
Inactive
2
77
-
-
-
-
DARPin D12
-
meclinertant
small-molecule
Inverse agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6Z4V
-
2.6
A
Intermediate
14
79
-
-
-
-
DARPin D12
-
JMV431
peptide
Agonist
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
NTR1
NTS1
Neurotensin
A
Rat
X-ray
6ZA8
-
2.7
A
Intermediate
14
78
-
-
-
-
DARPin D12
-
CHEMBL508044
small-molecule
Agonist (partial)
neurotensin, neuromedin N
peptide
Yes
No
Deluigi M, Klipp A, Klenk C, Merklinger L, Eberle SA, Morstein L, Heine P, Mittl PRE, Ernst P, Kamenecka TM, He Y, Vacca S, Egloff P, Honegger A, Pluckthun A
10.1126/sciadv.abe5504
2021-02-10
Yes
OX2R
OX2
Orexin
A
Human
cryo-EM
7L1U
7L1U_refined
3.2
R
Active
100
63
Gs
αs
Engineered G alpha
58
-
scFv16
Orexin-A
peptide
Agonist
orexin-A, orexin-B
peptide
Yes
No
Hong C, Byrne NJ, Zamlynny B, Tummala S, Xiao L, Shipman JM, Partridge AT, Minnick C, Breslin MJ, Rudd MT, Stachel SJ, Rada VL, Kern JC, Armacost KA, Hollingsworth SA, O'Brien JA, Hall DL, McDonald TP, Strickland C, Brooun A, Soisson SM, Hollenstein K
10.1038/S41467-021-21087-6
2021-02-10
Yes
LT4R1
BLT1
Leukotriene
A
Human
X-ray
7K15
7K15_refined
2.9
A
Inactive
3
85
-
-
-
-
Flavodoxin
-
N-(tert-butylsulfonyl)-4-fluoro-2-{(3S,4R)-4-hydroxy-3-[(pyridin-2-yl)methyl]-3,4-dihydro-2H-1-benzopyran-7-yl}benzamide
small-molecule
Antagonist
LTB4 , 20-hydroxy-LTB4 , 12R-HETE
small-molecule
Yes
Yes
-
-
2021-02-17
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7JVP
7JVP_refined
2.9
R
Active
100
63
Gs
αs
-
60
-
Nanobody-35
39YLC3L0ZU
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Zhuang Y, Xu P, Mao C, Wang L, Krumm B, Zhou XE, Huang S, Liu H, Cheng X, Huang XP, Shen DD, Xu T, Liu YF, Wang Y, Guo J, Jiang Y, Jiang H, Melcher K, Roth BL, Zhang Y, Zhang C, Xu HE
10.1016/J.CELL.2021.01.027
2021-02-24
Yes
DRD2
D2
Dopamine
A
Human
cryo-EM
7JVR
7JVR_refined
2.8
R
Active
100
61
Gi/o
αi1
-
63
-
scFv16
bromocriptine
small-molecule
Agonist
dopamine
small-molecule
Yes
No
Zhuang Y, Xu P, Mao C, Wang L, Krumm B, Zhou XE, Huang S, Liu H, Cheng X, Huang XP, Shen DD, Xu T, Liu YF, Wang Y, Guo J, Jiang Y, Jiang H, Melcher K, Roth BL, Zhang Y, Zhang C, Xu HE
10.1016/J.CELL.2021.01.027
2021-02-24
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7CKW
7CKW_refined
3.2
R
Active
100
61
Gs
αs
-
60
-
Nanobody-35
fenoldopam
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Xiao P, Yan W, Gou L, Zhong YN, Kong L, Wu C, Wen X, Yuan Y, Cao S, Qu C, Yang X, Yang CC, Xia A, Hu Z, Zhang Q, He YH, Zhang DL, Zhang C, Hou GH, Liu H, Zhu L, Fu P, Yang S, Rosenbaum DM, Sun JP, Du Y, Zhang L, Yu X, Shao Z
10.1016/J.CELL.2021.01.028
2021-03-03
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7CKY
7CKY_refined
3.2
R
Active
100
62
Gs
αs
-
60
-
Nanobody-35
CHEMBL3697578
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Xiao P, Yan W, Gou L, Zhong YN, Kong L, Wu C, Wen X, Yuan Y, Cao S, Qu C, Yang X, Yang CC, Xia A, Hu Z, Zhang Q, He YH, Zhang DL, Zhang C, Hou GH, Liu H, Zhu L, Fu P, Yang S, Rosenbaum DM, Sun JP, Du Y, Zhang L, Yu X, Shao Z
10.1016/J.CELL.2021.01.028
2021-03-03
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7CRH
7CRH_refined
3.3
R
Active
100
61
Gs
αs
-
60
-
Nanobody-35
CHEMBL1416789
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Xiao P, Yan W, Gou L, Zhong YN, Kong L, Wu C, Wen X, Yuan Y, Cao S, Qu C, Yang X, Yang CC, Xia A, Hu Z, Zhang Q, He YH, Zhang DL, Zhang C, Hou GH, Liu H, Zhu L, Fu P, Yang S, Rosenbaum DM, Sun JP, Du Y, Zhang L, Yu X, Shao Z
10.1016/J.CELL.2021.01.028
2021-03-03
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7LJD
-
3.2
R
Active
100
64
Gs
αs
Engineered G alpha
58
-
Nanobody-35
dopamine
LY3154207
small-molecule small-molecule
Agonist PAM
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Singh N, Singh D, Bhide A, Sharma R, Bhowmick S, Patel V, Modi D
10.1101/2021.02.07.430101
2021-03-03
Yes
DRD3
D3
Dopamine
A
Human
cryo-EM
7CMV
7CMV_refined
2.7
R
Active
100
68
Gi/o
αi1
-
64
BRIL
scFv16
CHEMBL70565
small-molecule
Agonist
dopamine
small-molecule
Yes
No
Xu P, Huang S, Mao C, Krumm BE, Zhou XE, Tan Y, Huang XP, Liu Y, Shen DD, Jiang Y, Yu X, Jiang H, Melcher K, Roth BL, Cheng X, Zhang Y, Xu HE
10.1016/J.MOLCEL.2021.01.003
2021-03-10
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DTU
7DTU_refined
4.4
A
Intermediate
-
72
-
-
-
-
-
-
L-tryptophan
small-molecule
PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Ling S, Shi P, Liu S, Meng X, Zhou Y, Sun W, Chang S, Zhang X, Zhang L, Shi C, Sun D, Liu L, Tian C
10.1038/S41422-021-00474-0
2021-03-10
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DTW
7DTW_refined
4.5
A
Inactive
-
72
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Ling S, Shi P, Liu S, Meng X, Zhou Y, Sun W, Chang S, Zhang X, Zhang L, Shi C, Sun D, Liu L, Tian C
10.1038/S41422-021-00474-0
2021-03-10
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
7ARO
7ARO_refined
3.1
A
Inactive
1
72
-
-
-
-
BRIL
-
CHEMBL124345
small-molecule
Agonist (partial)
adenosine
small-molecule
Yes
Yes
Amelia T, van Veldhoven JPD, Falsini M, Liu R, Heitman LH, van Westen GJP, Segala E, Verdon G, Cheng RKY, Cooke RM, van der Es D, IJzerman AP
10.1021/ACS.JMEDCHEM.0C01856
2021-04-07
Yes
5HT1A
5-HT1A
5-Hydroxytryptamine
A
Human
cryo-EM
7E2X
7E2X_refined
3.0
R
Active
100
66
Gi/o
αi1
-
62
-
-
Apo (no ligand)
none
Apo (no ligand)
5-hydroxytryptamine
small-molecule
Yes
No
Xu P, Huang S, Zhang H, Mao C, Zhou XE, Cheng X, Simon IA, Shen DD, Yen HY, Robinson CV, Harpsoe K, Svensson B, Guo J, Jiang H, Gloriam DE, Melcher K, Jiang Y, Zhang Y, Xu HE
10.1038/S41586-021-03376-8
2021-04-14
Yes
5HT1A
5-HT1A
5-Hydroxytryptamine
A
Human
cryo-EM
7E2Z
7E2Z_refined
3.1
R
Active
100
66
Gi/o
αi1
-
62
-
-
aripiprazole
small-molecule
Agonist (partial)
5-hydroxytryptamine
small-molecule
Yes
No
Xu P, Huang S, Zhang H, Mao C, Zhou XE, Cheng X, Simon IA, Shen DD, Yen HY, Robinson CV, Harpsoe K, Svensson B, Guo J, Jiang H, Gloriam DE, Melcher K, Jiang Y, Zhang Y, Xu HE
10.1038/S41586-021-03376-8
2021-04-14
Yes
DRD1
D1
Dopamine
A
Human
X-ray
7JOZ
7JOZ_refined
3.8
R
Active
100
64
Gs
αs
-
86
-
Nanobody-35
CHEMBL4453318
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2021-04-14
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7AUE
7AUE_refined
3.0
R
Active
100
79
Gs
αs
-
59
-
scFv16
setmelanotide
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
Israeli H, Degtjarik O, Fierro F, Chunilal V, Gill AK, Roth NJ, Botta J, Prabahar V, Peleg Y, Chan LF, Ben-Zvi D, McCormick PJ, Niv MY, Shalev-Benami M
10.1126/SCIENCE.ABF7958
2021-04-28
Yes
PE2R2
EP2
Prostanoid
A
Human
cryo-EM
7CX3
7CX3_refined
2.8
R
Active
100
74
Gs
αs
-
58
-
Nanobody-35
taprenepag
small-molecule
Agonist
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
Qu C, Mao C, Xiao P, Shen Q, Zhong YN, Yang F, Shen DD, Tao X, Zhang H, Yan X, Zhao RJ, He J, Guan Y, Zhang C, Hou G, Zhang PJ, Hou G, Li Z, Yu X, Chai RJ, Guan YF, Sun JP, Zhang Y
10.1126/SCIADV.ABF1268
2021-05-05
Yes
GABR2
GABAB2
GABAB
C
Human
cryo-EM
7EB2
7EB2_refined
3.5
D
Active
-
72
Gi/o
αi1
-
99
-
scFv16
(-)-baclofen
BHFF
small-molecule small-molecule
Agonist PAM
-
-
No
No
Shen C, Mao C, Xu C, Jin N, Zhang H, Shen DD, Shen Q, Wang X, Hou T, Chen Z, Rondard P, Pin JP, Zhang Y, Liu J
10.1038/S41586-021-03507-1
2021-05-05
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7MBY
7MBY_refined
2.4
R
Active
100
66
Gq/11
αq
Gq-Gs-Gi1 chimera
55
-
-
CHEMBL216166
protein
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
-
-
2021-05-26
Yes
V2R
V2
Vasopressin and oxytocin
A
Human
cryo-EM
7BB7
7BB7_refined
4.4
A
Active
100
72
Gs
αs
-
55
-
Nanobody-35
vasopressin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Bous J, Orcel H, Floquet N, Leyrat C, Lai-Kee-Him J, Gaibelet G, Ancelin A, Saint-Paul J, Trapani S, Louet M, Sounier R, Demene H, Granier S, Bron P, Mouillac B
10.1126/SCIADV.ABG5628
2021-06-02
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7DD5
-
3.2
A
Inactive
-
74
-
-
-
-
-
-
Calcium
NPS 2143
L-tryptophan
small-molecule small-molecule small-molecule
Agonist NAM PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Wen T, Wang Z, Chen X, Ren Y, Lu X, Xing Y, Lu J, Chang S, Zhang X, Shen Y, Yang X
10.1126/SCIADV.ABG1483
2021-06-16
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7E9G
7E9G_refined
3.5
R
Intermediate
-
88
Gi/o
αi1
-
63
-
scFv16
eglumegad
JNJ-40411813
small-molecule small-molecule
Agonist PAM
L-glutamic acid
small-molecule
No
No
Lin S, Han S, Cai X, Tan Q, Zhou K, Wang D, Wang X, Du J, Yi C, Chu X, Dai A, Zhou Y, Chen Y, Zhou Y, Liu H, Liu J, Yang D, Wang MW, Zhao Q, Wu B
10.1038/S41586-021-03495-2
2021-06-23
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7EPA
7EPA_refined
3.6
A
Intermediate
-
90
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
GRM7
mGlu7
Metabotropic glutamate
C
Human
cryo-EM
7EPC
7EPC_refined
4.0
B
Inactive
-
85
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
L-serine-O-phosphate, L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
X-ray
7EPE
7EPE_refined
2.5
A
Inactive
-
28
-
-
-
-
Flavodoxin
-
CHEMBL3894759
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
Du J, Wang D, Fan H, Xu C, Tai L, Lin S, Han S, Tan Q, Wang X, Xu T, Zhang H, Chu X, Yi C, Liu P, Wang X, Zhou Y, Pin JP, Rondard P, Liu H, Liu J, Sun F, Wu B, Zhao Q
10.1038/S41586-021-03641-W
2021-06-23
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7M3E
-
3.2
B
Inactive
-
75
-
-
-
-
-
-
Calcium
NPS 2143
L-tryptophan
small-molecule small-molecule small-molecule
Agonist NAM PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Gao Y, Robertson MJ, Rahman SN, Seven AB, Zhang C, Meyerowitz JG, Panova O, Hannan FM, Thakker RV, Brauner-Osborne H, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03691-0
2021-06-30
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7M3G
7M3G_refined
2.5
A
Active
-
76
-
-
-
-
-
-
Calcium
L-tryptophan
evocalcet
small-molecule small-molecule small-molecule
Agonist PAM PAM
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Gao Y, Robertson MJ, Rahman SN, Seven AB, Zhang C, Meyerowitz JG, Panova O, Hannan FM, Thakker RV, Brauner-Osborne H, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03691-0
2021-06-30
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7E14
7E14_refined
2.9
R
Active
100
81
Gs
αs
-
48
-
Nanobody-35
N-Tert-butyl-6,7-dichloroquinoxalin-2-amine
LY3502970
small-molecule small-molecule
Ago-PAM Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Chen LN, Ma H, Zhou Q, Zou X, Ye C, Dai A, Liu Q, Huang W, Sun X, Wang X, Xu P, Zhao L, Xia T, Zhong W, Yang D, Eric Xu H, Zhang Y, Wang MW
10.1038/S41467-021-24058-Z
2021-07-07
Yes
Q3KSP2
BILF1
Unclassified
A
strain GD1
cryo-EM
7JHJ
7JHJ_refined
3.2
R
Active
100
89
Gi/o
αi1
-
62
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Tsutsumi N, Qu Q, Mavri M, Baggesen MS, Maeda S, Waghray D, Berg C, Kobilka BK, Rosenkilde MM, Skiniotis G, Garcia KC
10.1016/J.IMMUNI.2021.06.001
2021-07-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
7MT8
7MT8_refined
5.8
R
Active
97
93
-
-
-
-
-
GRK1
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Chen Q, Plasencia M, Li Z, Mukherjee S, Patra D, Chen CL, Klose T, Yao XQ, Kossiakoff AA, Chang L, Andrews PC, Tesmer JJG
10.1038/S41586-021-03721-X
2021-07-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
7MT9
7MT9_refined
7.0
R
Active
97
93
-
-
-
-
-
GRK1
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Chen Q, Plasencia M, Li Z, Mukherjee S, Patra D, Chen CL, Klose T, Yao XQ, Kossiakoff AA, Chang L, Andrews PC, Tesmer JJG
10.1038/S41586-021-03721-X
2021-07-07
Yes
OPSD
Rhodopsin
Opsins
A
Bovine
cryo-EM
7MTB
7MTB_refined
4.0
R
Active
97
93
-
-
-
-
-
Fab light chain Fab heavy chain GRK1
Retinal (all-trans)
small-molecule
Agonist
-
-
No
No
Chen Q, Plasencia M, Li Z, Mukherjee S, Patra D, Chen CL, Klose T, Yao XQ, Kossiakoff AA, Chang L, Andrews PC, Tesmer JJG
10.1038/S41586-021-03721-X
2021-07-07
Yes
GRM2
mGlu2
Metabotropic glutamate
C
Human
cryo-EM
7MTR
7MTR_refined
3.3
A
Active
-
88
-
-
-
-
-
-
2-methoxy-6-propyl-N-(2-{4-[(1H-tetrazol-5-yl)methoxy]phenyl}ethyl)thieno[2,3-d]pyrimidin-4-amine
L-glutamic acid
small-molecule small-molecule
Ago-PAM Agonist
L-glutamic acid
small-molecule
No
No
Seven AB, Barros-Alvarez X, de Lapeyriere M, Papasergi-Scott MM, Robertson MJ, Zhang C, Nwokonko RM, Gao Y, Meyerowitz JG, Rocher JP, Schelshorn D, Kobilka BK, Mathiesen JM, Skiniotis G
10.1038/S41586-021-03680-3
2021-07-07
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7DUQ
7DUQ_refined
2.5
R
Active
100
83
Gs
αs
-
61
-
Nanobody-35
N-Tert-butyl-6,7-dichloroquinoxalin-2-amine
CHEMBL410972
small-molecule protein
Ago-PAM Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Chen LN, Ma H, Zhou Q, Zou X, Ye C, Dai A, Liu Q, Huang W, Sun X, Wang X, Xu P, Zhao L, Xia T, Zhong W, Yang D, Eric Xu H, Zhang Y, Wang MW
10.1038/S41467-021-24058-Z
2021-07-14
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
7F1R
7F1R_refined
3.0
R
Active
100
79
Gi/o
αi1
-
61
-
-
CCL5
peptide
Agonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Zhang H, Chen K, Tan Q, Shao Q, Han S, Zhang C, Yi C, Chu X, Zhu Y, Xu Y, Zhao Q, Wu B
10.1038/S41467-021-24438-5
2021-07-14
Yes
CCR5
CCR5
Chemokine
A
Human
cryo-EM
7F1S
7F1S_refined
2.8
R
Active
100
78
Gi/o
αi1
-
61
-
-
Apo (no ligand)
none
Apo (no ligand)
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
Zhang H, Chen K, Tan Q, Shao Q, Han S, Zhang C, Yi C, Chu X, Zhu Y, Xu Y, Zhao Q, Wu B
10.1038/S41467-021-24438-5
2021-07-14
Yes
CCR5
CCR5
Chemokine
A
Human
X-ray
7F1T
-
2.6
A
Inactive
16
86
-
-
-
-
Rubredoxin
-
CCL3
peptide
Agonist
CCL14, CCL5, CCL2, CCL4, CCL3, CCL13, CCL8, CCL7, CCL16, CCL11
peptide
No
No
-
-
2021-07-14
Yes
V2R
V2
Vasopressin and oxytocin
A
Human
cryo-EM
7DW9
-
2.6
R
Active
100
75
Gs
αs
-
56
-
Nanobody-35 scFv16
vasopressin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Zhou F, Ye C, Ma X, Yin W, Croll TI, Zhou Q, He X, Zhang X, Yang D, Wang P, Xu HE, Wang MW, Jiang Y
10.1038/S41422-021-00480-2
2021-07-21
Yes
ADRB3
β3
Adrenoceptors
A
Dog
cryo-EM
7DH5
7DH5_refined
3.2
R
Active
100
68
Gs
αs
-
59
-
Nanobody-35
mirabegron
small-molecule
Agonist
-
-
Yes
No
Nagiri C, Kobayashi K, Tomita A, Kato M, Kobayashi K, Yamashita K, Nishizawa T, Inoue A, Shihoya W, Nureki O
10.1016/J.MOLCEL.2021.06.024
2021-08-04
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7DTY
7DTY_refined
3.0
R
Active
100
79
Gs
αs
-
59
-
Nanobody-35
GIP
small-molecule
Agonist
gastric inhibitory polypeptide
peptide
No
No
Zhao F, Zhang C, Zhou Q, Hang K, Zou X, Chen Y, Wu F, Rao Q, Dai A, Yin W, Shen DD, Zhang Y, Xia T, Stevens RC, Xu HE, Yang D, Zhao L, Wang MW
10.7554/ELIFE.68719
2021-08-04
Yes
FZD7
FZD7
Frizzled
F
Human
cryo-EM
7EVW
-
3.2
R
Active
100
59
Gs
αs
-
58
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Xu L, Chen B, Schihada H, Wright SC, Turku A, Wu Y, Han GW, Kowalski-Jahn M, Kozielewicz P, Bowin CF, Zhang X, Li C, Bouvier M, Schulte G, Xu F
10.1038/S41422-021-00525-6
2021-08-04
Yes
5HT1F
5-HT1F
5-Hydroxytryptamine
A
Human
cryo-EM
7EXD
7EXD_refined
3.4
R
Active
100
74
Gi/o
αi1
-
62
BRIL
scFv16
lasmiditan
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Tan Y, You C, Zhang Y, Jiang Y, Xu HE
10.1038/S41422-021-00527-4
2021-08-04
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7KI0
-
2.5
R
Active
100
83
Gs
αs
-
53
-
Nanobody-35
semaglutide
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhang X, Belousoff MJ, Liang YL, Danev R, Sexton PM, Wootten D
10.1016/J.CELREP.2021.109374
2021-08-04
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7KI1
7KI1_refined
2.5
R
Active
100
83
Gs
αs
-
89
-
Nanobody-35
Taspoglutide
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhang X, Belousoff MJ, Liang YL, Danev R, Sexton PM, Wootten D
10.1016/J.CELREP.2021.109374
2021-08-04
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7DUR
7DUR_refined
3.3
R
Active
100
80
Gs
αs
-
60
-
Nanobody-35
N-Tert-butyl-6,7-dichloroquinoxalin-2-amine
small-molecule
Ago-PAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Chen LN, Ma H, Zhou Q, Zou X, Ye C, Dai A, Liu Q, Huang W, Sun X, Wang X, Xu P, Zhao L, Xia T, Zhong W, Yang D, Eric Xu H, Zhang Y, Wang MW
10.1038/S41467-021-24058-Z
2021-08-11
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7EVM
7EVM_refined
2.5
R
Active
100
61
Gs
αs
-
60
-
Nanobody-35
N-Tert-butyl-6,7-dichloroquinoxalin-2-amine
small-molecule
Ago-PAM
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Chen LN, Ma H, Zhou Q, Zou X, Ye C, Dai A, Liu Q, Huang W, Sun X, Wang X, Xu P, Zhao L, Xia T, Zhong W, Yang D, Eric Xu H, Zhang Y, Wang MW
10.1038/S41467-021-24058-Z
2021-08-11
Yes
MTR1A
MT1
Melatonin
A
Human
cryo-EM
7DB6
7DB6_refined
3.3
D
Active
100
79
Gi/o
αi1
-
62
-
scFv16
ramelteon
small-molecule
Agonist
melatonin
small-molecule
Yes
No
Okamoto HH, Miyauchi H, Inoue A, Raimondi F, Tsujimoto H, Kusakizako T, Shihoya W, Yamashita K, Suno R, Nomura N, Kobayashi T, Iwata S, Nishizawa T, Nureki O
10.1038/S41594-021-00634-1
2021-08-18
Yes
PTH2R
PTH2
Parathyroid hormone
B1
Human
cryo-EM
7F16
7F16_refined
2.8
R
Active
100
68
Gs
αs
-
58
-
Nanobody-35
TIP39
peptide
Agonist
PTHrP-(1-36), TIP39, PTHrP, PTHrP-(1-34) (human), PTH
peptide
No
No
Wang X, Cheng X, Zhao L, Wang Y, Ye C, Zou X, Dai A, Cong Z, Chen J, Zhou Q, Xia T, Jiang H, Xu HE, Yang D, Wang MW
10.1073/PNAS.2101279118
2021-08-18
Yes
GHSR
ghrelin
Ghrelin
A
Human
cryo-EM
7F9Y
7F9Y_refined
2.9
R
Active
100
78
Gq/11
αq
Engineered G alpha
59
-
Nanobody-35
ghrelin
peptide
Agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
Yes
No
-
-
2021-08-18
Yes
GHSR
ghrelin
Ghrelin
A
Human
cryo-EM
7F9Z
7F9Z_refined
3.2
R
Active
100
77
Gq/11
αq
Engineered G alpha
59
-
Nanobody-35 scFv16
GHRP-6
peptide
Agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
Yes
No
-
-
2021-08-18
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7EZH
7EZH_refined
3.2
D
Active
100
69
Gi/o
αi1
-
61
-
scFv16
CCK-8
peptide
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
-
-
2021-08-25
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7EZK
7EZK_refined
3.1
D
Active
100
69
Gs
αs
-
58
-
-
CCK-8
peptide
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
-
-
2021-08-25
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7EZM
-
2.9
D
Active
100
71
Gq/11
αq
-
63
-
scFv16
CCK-8
peptide
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
-
-
2021-08-25
Yes
PD2R2
DP2
Prostanoid
A
Human
X-ray
7M8W
7M8W_refined
2.6
A
Inactive
24
83
-
-
-
-
T4-Lysozyme
-
15(R )-15-methyl-PGD2
small-molecule
Antagonist
PGJ2 , PGD2 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
Yes
Liu H, Deepak RNVK, Shiriaeva A, Gati C, Batyuk A, Hu H, Weierstall U, Liu W, Wang L, Cherezov V, Fan H, Zhang C
10.1073/PNAS.2102813118
2021-08-25
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
cryo-EM
7FD8
7FD8_refined
3.8
A
Active
-
63
-
-
-
-
-
-
quisqualate
small-molecule
Agonist
L-glutamic acid
small-molecule
No
No
-
-
2021-09-08
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
cryo-EM
7FD9
7FD9_refined
4.0
A
Inactive
-
63
-
-
-
-
-
-
LY341495
small-molecule
Antagonist
L-glutamic acid
small-molecule
No
No
-
-
2021-09-08
Yes
AA1R
A1
Adenosine
A
Human
cryo-EM
7LD3
7LD3_refined
3.2
R
Active
100
88
Gi/o
αi2
-
59
-
-
adenosine
{2-Amino-4-[3,5-bis(trifluoromethyl)phenyl]thiophen-3-yl}(4-chlorophenyl)methanone
small-molecule small-molecule
Agonist PAM
adenosine
small-molecule
Yes
No
-
-
2021-09-08
Yes
AA1R
A1
Adenosine
A
Human
cryo-EM
7LD4
7LD4_refined
3.3
R
Active
100
88
Gi/o
αi2
-
59
-
-
adenosine
small-molecule
Agonist
adenosine
small-molecule
Yes
No
-
-
2021-09-08
Yes
GRM5
mGlu5
Metabotropic glutamate
C
Human
X-ray
7P2L
7P2L_refined
2.5
A
Inactive
-
21
-
-
-
-
T4-Lysozyme
-
alloswitch-1
small-molecule
NAM
L-glutamic acid
small-molecule
No
No
-
-
2021-09-08
Yes
AA2AR
A2A
Adenosine
A
Human
MicroED
7RM5
7RM5_refined
2.8
A
Inactive
1
72
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
Martynowycz MW, Shiriaeva A, Ge X, Hattne J, Nannenga BL, Cherezov V, Gonen T
10.1073/PNAS.2106041118
2021-09-08
Yes
GRM1
mGlu1
Metabotropic glutamate
C
Human
cryo-EM
7DGD
7DGD_refined
4.0
A
Inactive
-
66
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
L-glutamic acid
small-molecule
No
No
Zhang J, Qu L, Wu L, Tang X, Luo F, Xu W, Xu Y, Liu ZJ, Hua T
10.1007/S13238-020-00808-5
2021-09-22
Yes
GRM1
mGlu1
Metabotropic glutamate
C
Human
cryo-EM
7DGE
7DGE_refined
3.7
A
Intermediate
-
66
-
-
-
-
-
Nanobody-43
quisqualate
small-molecule
Agonist
L-glutamic acid
small-molecule
No
No
Zhang J, Qu L, Wu L, Tang X, Luo F, Xu W, Xu Y, Liu ZJ, Hua T
10.1007/S13238-020-00808-5
2021-09-22
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7E6U
7E6U_refined
6.0
A
Inactive
-
72
-
-
-
-
-
Nanobody-2D11
Apo (no ligand)
none
Apo (no ligand)
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Chen X, Wang L, Cui Q, Ding Z, Han L, Kou Y, Zhang W, Wang H, Jia X, Dai M, Shi Z, Li Y, Li X, Geng Y
10.7554/ELIFE.68578
2021-09-22
Yes
S1PR3
S1P3
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW2
7EW2_refined
3.1
R
Active
100
77
Gi/o
αi1
-
64
-
scFv16
(S)-FTY720-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Zhao C, Cheng L, Wang W, Wang H, Luo Y, Feng Y, Wang X, Fu H, Cai Y, Yang S, Fu P, Yan W, Shao Z
10.1038/S41422-021-00567-W
2021-09-29
Yes
S1PR3
S1P3
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW4
-
3.2
R
Active
100
76
Gi/o
αi1
-
64
-
scFv16
CYM-5541
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Zhao C, Cheng L, Wang W, Wang H, Luo Y, Feng Y, Wang X, Fu H, Cai Y, Yang S, Fu P, Yan W, Shao Z
10.1038/S41422-021-00567-W
2021-09-29
Yes
LSHR
LH
Glycoprotein hormone
A
Human
cryo-EM
7FIH
-
3.2
R
Active
100
79
Gs
αs
-
56
-
-
Choriogonadotropin beta
Glycoprotein alpha
5-Amino-N-(1,1-dimethylethyl)-2-(methylthio)-4-[3-[[2-(4-morpholinyl)acetyl]amino]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide
protein protein small-molecule
Agonist
LH, hCG
peptide
Yes
No
Duan J, Xu P, Cheng X, Mao C, Croll T, He X, Shi J, Luan X, Yin W, You E, Liu Q, Zhang S, Jiang H, Zhang Y, Jiang Y, Xu HE
10.1038/S41586-021-03924-2
2021-09-29
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
X-ray
7F8U
7F8U_refined
2.8
A
Inactive
1
65
-
-
-
-
T4-Lysozyme
-
lintitript
small-molecule
Antagonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
No
No
Zhang X, He C, Wang M, Zhou Q, Yang D, Zhu Y, Feng W, Zhang H, Dai A, Chu X, Wang J, Yang Z, Jiang Y, Sensfuss U, Tan Q, Han S, Reedtz-Runge S, Xu HE, Zhao S, Wang MW, Wu B, Zhao Q
10.1038/S41589-021-00866-8
2021-10-13
Yes
LSHR
LH
Glycoprotein hormone
A
Human
cryo-EM
7FIJ
7FIJ_refined
3.8
R
Inactive
5
80
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
LH, hCG
peptide
Yes
No
Duan J, Xu P, Cheng X, Mao C, Croll T, He X, Shi J, Luan X, Yin W, You E, Liu Q, Zhang S, Jiang H, Zhang Y, Jiang Y, Xu HE
10.1038/S41586-021-03924-2
2021-09-29
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
X-ray
6ZG9
6ZG9_refined
2.5
A
Inactive
3
62
-
-
-
-
T4-Lysozyme
-
7-fluoro-5-methyl-3-[1-(oxan-4-yl)piperidin-4-yl]-1H-benzimidazol-2-one
small-molecule
Agonist
acetylcholine
small-molecule
No
No
-
-
2021-10-06
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
X-ray
6ZG4
6ZG4_refined
2.3
A
Inactive
3
62
-
-
-
-
T4-Lysozyme
-
Ethyl (4S)-4-[4-[(1-methylcyclobutyl)carbamoyl]piperidin-1-yl]azepane-1-carboxylate
small-molecule
Agonist
acetylcholine
small-molecule
No
No
-
-
2021-10-06
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
7V3Z
7V3Z_refined
3.3
A
Active
96
60
-
-
-
-
Flavodoxin
-
CP55940
small-molecule
Agonist
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Wang X, Liu D, Shen L, Li F, Li Y, Yang L, Xu T, Tao H, Yao D, Wu L, Hirata K, Bohn LM, Makriyannis A, Liu X, Hua T, Liu ZJ, Wang J
10.1021/JACS.1C06847
2021-11-24
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
X-ray
7F8Y
7F8Y_refined
2.5
A
Inactive
1
65
-
-
-
-
T4-Lysozyme
-
DEVAZEPIDE
small-molecule
Antagonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
No
No
-
-
2021-10-13
Yes
ACM1
M1
Acetylcholine (muscarinic)
A
Human
X-ray
6ZFZ
6ZFZ_refined
2.2
A
Inactive
3
62
-
-
-
-
T4-Lysozyme
-
CHEMBL3354065
small-molecule
Agonist
acetylcholine
small-molecule
No
No
-
-
2021-10-06
Yes
GASR
CCK2
Cholecystokinin
A
Human
cryo-EM
7F8W
7F8W_refined
3.1
R
Active
100
62
Gq/11
αq
Gq-Gi1 chimera
62
-
scFv16
desulfated gastrin-17
peptide
Agonist
CCK-4, gastrin-17, gastrin-71, desulfated cholecystokinin-8, desulfated gastrin-34, desulfated gastrin-71, gastrin-14, desulfated gastrin-14, CCK-33, gastrin-34, CCK-58, CCK-39, CCK-8, desulfated gastrin-17
peptide
Yes
No
-
-
2021-10-13
Yes
GASR
CCK2
Cholecystokinin
A
Human
cryo-EM
7F8V
7F8V_refined
3.3
R
Active
100
62
Gi/o
αi2
-
61
-
-
desulfated gastrin-17
peptide
Agonist
CCK-4, gastrin-17, gastrin-71, desulfated cholecystokinin-8, desulfated gastrin-34, desulfated gastrin-71, gastrin-14, desulfated gastrin-14, CCK-33, gastrin-34, CCK-58, CCK-39, CCK-8, desulfated gastrin-17
peptide
Yes
No
-
-
2021-10-13
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7F55
7F55_refined
3.1
R
Active
100
82
Gs
αs
-
58
-
Nanobody-35
bremelanotide
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
-
10.1038/S41422-021-00552-3
2021-11-03
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7PIV
7PIV_refined
2.9
R
Active
100
78
Gs
αs
-
46
-
Nanobody-35
afamelanotide
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
-
-
2021-11-17
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7RTB
7RTB_refined
2.1
R
Active
100
83
Gs
αs
-
60
-
Nanobody-35
Peptide-19
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
-
10.1016/J.BBRC.2021.09.016
2021-10-06
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7S8O
7S8O_refined
2.6
R
Active
100
78
Gi/o
αi1
-
62
BRIL
scFv16
(R)-ZINC-3573
small-molecule
Agonist
PAMP-20
peptide
No
No
-
-
2021-11-17
Yes
BKRB1
B1
Bradykinin
A
Human
cryo-EM
7EIB
7EIB_refined
3.0
A
Active
100
84
Gq/11
αq
Gq-Gi1 chimera
61
-
-
[des-Arg10 ]kallidin
peptide
Agonist
[Hyp3 ]bradykinin, [des-Arg10 ]kallidin, Lys-[Hyp3 ]-bradykinin, kallidin, T-kinin, [des-Arg9 ]bradykinin, bradykinin
peptide
Yes
No
-
10.1038/S41594-021-00645-Y
2021-10-13
Yes
GP158
GPR158
C Orphans
C
Human
cryo-EM
7SHE
7SHE_refined
3.4
A
Inactive
-
45
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Patil DN, Singh S, Laboute T, Strutzenberg TS, Qiu X, Wu D, Novick SJ, Robinson CV, Griffin PR, Hunt JF, Izard T, Singh AK, Martemyanov KA
34793198
2021-12-01
Yes
NK1R
NK1
Tachykinin
A
Human
cryo-EM
7RMH
7RMH_refined
3.1
R
Active
100
70
Gs
αs
-
55
-
Nanobody-35
substance P
peptide
Agonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
-
10.1038/S41589-021-00890-8
2021-11-03
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7F58
7F58_refined
3.1
R
Active
100
82
Gs
αs
-
58
-
Nanobody-35
THIQ
small-molecule
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
-
-
2021-11-03
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7S8L
7S8L_refined
2.5
R
Active
100
76
Gq/11
αq
Gq-Gs chimera
57
-
scFv16
Cortistatin 14
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-11-17
Yes
NK1R
NK1
Tachykinin
A
Human
cryo-EM
7RMG
7RMG_refined
3.0
R
Active
100
71
Gs
αs
Gs-Gq chimera
49
-
Nanobody-35
substance P
peptide
Agonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
-
-
2021-11-03
Yes
LSHR
LH
Glycoprotein hormone
A
Human
cryo-EM
7FII
-
4.3
R
Active
100
82
Gs
αs
-
91
-
-
Choriogonadotropin beta
Glycoprotein alpha
protein protein
Agonist
LH, hCG
peptide
Yes
No
Duan J, Xu P, Cheng X, Mao C, Croll T, He X, Shi J, Luan X, Yin W, You E, Liu Q, Zhang S, Jiang H, Zhang Y, Jiang Y, Xu HE
10.1038/S41586-021-03924-2
2021-09-29
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7F54
7F54_refined
3.0
R
Active
100
82
Gs
αs
-
58
-
Nanobody-35
afamelanotide
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
-
-
2021-11-03
Yes
NK1R
NK1
Tachykinin
A
Human
cryo-EM
7RMI
7RMI_refined
3.2
R
Active
100
70
Gs
αs
Gs-Gq chimera
49
-
Nanobody-35
substance P
peptide
Agonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
-
-
2021-11-03
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7S8N
7S8N_refined
2.9
R
Active
100
76
Gq/11
αq
Gq-Gs chimera
57
-
scFv16
(R)-ZINC-3573
small-molecule
Agonist
PAMP-20
peptide
No
No
-
-
2021-11-17
Yes
MRGX4
MRGPRX4
A orphans
A
Human
cryo-EM
7S8P
7S8P_refined
2.6
R
Active
100
77
Gq/11
αq
Gq-Gs chimera
57
BRIL
scFv16
N-[(1r,3R,5S,7R)-3,5-dimethyltricyclo[3.3.1.1~3,7~]decane-1-carbonyl]-D-phenylalanine
small-molecule
Agonist
-
-
No
No
-
-
2021-11-17
Yes
BKRB2
B2
Bradykinin
A
Human
cryo-EM
7F2O
7F2O_refined
2.9
R
Active
100
73
Gq/11
αq
Gq-Gi1 chimera
60
-
scFv16
bradykinin
peptide
Agonist
[Hyp3 ]bradykinin, [des-Arg10 ]kallidin, Lys-[Hyp3 ]-bradykinin, kallidin, T-kinin, [des-Arg9 ]bradykinin, bradykinin
peptide
Yes
No
-
-
2021-10-13
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7PIU
-
2.6
R
Active
100
78
Gs
αs
-
48
-
Nanobody-35
setmelanotide
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
Heyder NA, Kleinau G, Speck D, Schmidt A, Paisdzior S, Szczepek M, Bauer B, Koch A, Gallandi M, Kwiatkowski D, Burger J, Mielke T, Beck-Sickinger AG, Hildebrand PW, Spahn CMT, Hilger D, Schacherl M, Biebermann H, Hilal T, Kuhnen P, Kobilka BK, Scheerer P
10.1038/S41422-021-00569-8
2021-11-17
Yes
MC4R
MC4
Melanocortin
A
Human
cryo-EM
7F53
7F53_refined
3.0
R
Active
100
82
Gs
αs
-
58
-
Nanobody-35
α-MSH
peptide
Agonist
ACTH, β-MSH, α-MSH, γ-MSH, agouti-related protein
peptide
Yes
No
-
-
2021-11-03
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7S8M
7S8M_refined
2.5
R
Active
100
77
Gi/o
αi1
-
62
BRIL
scFv16
Cortistatin 14
peptide
Agonist
PAMP-20
peptide
No
No
Cao C, Kang HJ, Singh I, Chen H, Zhang C, Ye W, Hayes BW, Liu J, Gumpper RH, Bender BJ, Slocum ST, Krumm BE, Lansu K, McCorvy JD, Kroeze WK, English JG, DiBerto JF, Olsen RHJ, Huang XP, Zhang S, Liu Y, Kim K, Karpiak J, Jan LY, Abraham SN, Jin J, Shoichet BK, Fay JF, Roth BL
10.1038/S41586-021-04126-6
2021-11-17
Yes
GP158
GPR158
C Orphans
C
Human
cryo-EM
7EWL
7EWL_refined
3.5
A
Inactive
-
41
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
-
10.1038/S41467-021-27147-1
2021-12-01
Yes
GP158
GPR158
C Orphans
C
Human
cryo-EM
7SHF
7SHF_refined
3.4
B
Inactive
-
23
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Patil DN, Singh S, Laboute T, Strutzenberg TS, Qiu X, Wu D, Novick SJ, Robinson CV, Griffin PR, Hunt JF, Izard T, Singh AK, Martemyanov KA
34793198
2021-12-01
Yes
GP158
GPR158
C Orphans
C
Human
cryo-EM
7EWP
7EWP_refined
4.3
A
Inactive
-
47
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
-
-
2021-12-01
Yes
GP158
GPR158
C Orphans
C
Human
cryo-EM
7EWR
7EWR_refined
4.7
A
Inactive
-
47
-
-
-
-
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VDH
7VDH_refined
2.9
R
Active
100
81
Gi/o
αi1
-
62
-
scFv16
compound 48/80
small-molecule
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VDL
7VDL_refined
3.2
R
Active
100
78
Gi/o
αi1
-
61
-
scFv16
Cortistatin 14
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VDM
7VDM_refined
3.0
R
Active
100
77
Gi/o
αi1
-
61
-
scFv16
substance P
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VUY
-
2.8
R
Active
100
78
Gi/o
αi1
-
64
-
scFv16
PAMP-12
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VUZ
-
2.9
R
Active
100
76
Gi/o
αi1
-
62
-
scFv16
PAMP-12
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VV0
7VV0_refined
3.5
R
Active
97
80
-
-
-
-
-
-
PAMP-12
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VV3
-
3.0
R
Active
100
79
Gi/o
αi1
-
62
-
scFv16
Cortistatin 14
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VV4
7VV4_refined
3.0
R
Active
97
80
-
-
-
-
-
-
Cortistatin 14
peptide
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VV5
7VV5_refined
2.8
R
Active
100
81
Gi/o
αi1
-
64
-
scFv16
compound 48/80
small-molecule
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
MRGX2
MRGPRX2
A orphans
A
Human
cryo-EM
7VV6
7VV6_refined
3.3
R
Active
97
82
-
-
-
-
-
-
compound 48/80
small-molecule
Agonist
PAMP-20
peptide
No
No
-
-
2021-12-01
Yes
GHSR
ghrelin
Ghrelin
A
Human
cryo-EM
7NA7
7NA7_refined
2.7
R
Active
100
80
Gi/o
αi1
-
61
-
Antibody fragment
Ghrelin-27
peptide
Agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
No
No
Liu H, Sun D, Myasnikov A, Damian M, Baneres JL, Sun J, Zhang C
10.1038/S41467-021-26735-5
2021-12-15
Yes
GHSR
ghrelin
Ghrelin
A
Human
cryo-EM
7NA8
7NA8_refined
2.7
R
Active
100
78
Gi/o
αi1
-
61
-
Antibody fragment
ibutamoren
small-molecule
Agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
No
No
Liu H, Sun D, Myasnikov A, Damian M, Baneres JL, Sun J, Zhang C
10.1038/S41467-021-26735-5
2021-12-15
Yes
NK1R
NK1
Tachykinin
A
Human
cryo-EM
7P00
7P00_refined
2.7
R
Active
100
71
Gq/11
αq
Gq-Gs-Gi1 chimera
59
-
scFv16
substance P
peptide
Agonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Thom C, Ehrenmann J, Vacca S, Waltenspuhl Y, Schoppe J, Medalia O, Pluckthun A
10.1126/SCIADV.ABK2872
2021-12-15
Yes
NK1R
NK1
Tachykinin
A
Human
cryo-EM
7P02
7P02_refined
2.9
R
Active
100
71
Gs
αs
Gs-Gi1 chimera
57
-
scFv16
substance P
peptide
Agonist
neurokinin A, neuropeptide-γ, neuropeptide K, substance P, neurokinin B, hemokinin 1
peptide
Yes
No
Thom C, Ehrenmann J, Vacca S, Waltenspuhl Y, Schoppe J, Medalia O, Pluckthun A
10.1126/SCIADV.ABK2872
2021-12-15
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7VOD
7VOD_refined
3.3
A
Inactive
1
58
-
-
-
-
BRIL
-
cariprazine
small-molecule
Agonist (partial)
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Chen Z, Fan L, Wang H, Yu J, Lu D, Qi J, Nie F, Luo Z, Liu Z, Cheng J, Wang S
10.1038/S41593-021-00971-W
2021-12-22
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7VOE
7VOE_refined
2.9
A
Inactive
1
58
-
-
-
-
BRIL
-
aripiprazole
small-molecule
Agonist (partial)
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Chen Z, Fan L, Wang H, Yu J, Lu D, Qi J, Nie F, Luo Z, Liu Z, Cheng J, Wang S
10.1038/S41593-021-00971-W
2021-12-22
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
X-ray
7F8X
7F8X_refined
3.0
A
Inactive
1
66
-
-
-
-
T4-Lysozyme
-
NN9056
peptide
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
Zhang X, He C, Wang M, Zhou Q, Yang D, Zhu Y, Feng W, Zhang H, Dai A, Chu X, Wang J, Yang Z, Jiang Y, Sensfuss U, Tan Q, Han S, Reedtz-Runge S, Xu HE, Zhao S, Wang MW, Wu B, Zhao Q
10.1038/S41589-021-00866-8
2021-12-29
Yes
GP139
GPR139
A orphans
A
Human
cryo-EM
7VUG
7VUG_refined
3.2
R
Active
100
80
Gi/o
αi1
-
62
-
scFv16
JNJ-63533054
small-molecule
Agonist
L-tryptophan, L-phenylalanine
small-molecule
Yes
No
Zhou Y, Daver H, Trapkov B, Wu L, Wu M, Harpsoe K, Gentry PR, Liu K, Larionova M, Liu J, Chen N, Brauner-Osborne H, Gloriam DE, Hua T, Liu ZJ
10.1038/S41422-021-00591-W
2021-12-29
Yes
GP139
GPR139
A orphans
A
Human
cryo-EM
7VUI
-
3.3
R
Active
100
79
Gs
αs
-
57
-
Nanobody-35
JNJ-63533054
small-molecule
Agonist
L-tryptophan, L-phenylalanine
small-molecule
Yes
No
Zhou Y, Daver H, Trapkov B, Wu L, Wu M, Harpsoe K, Gentry PR, Liu K, Larionova M, Liu J, Chen N, Brauner-Osborne H, Gloriam DE, Hua T, Liu ZJ
10.1038/S41422-021-00591-W
2021-12-29
Yes
GP139
GPR139
A orphans
A
Human
cryo-EM
7VUH
-
3.2
R
Active
100
80
Gs
αs
-
59
-
Nanobody-35
JNJ-63533054
small-molecule
Agonist
L-tryptophan, L-phenylalanine
small-molecule
Yes
No
Zhou Y, Daver H, Trapkov B, Wu L, Wu M, Harpsoe K, Gentry PR, Liu K, Larionova M, Liu J, Chen N, Brauner-Osborne H, Gloriam DE, Hua T, Liu ZJ
10.1038/S41422-021-00591-W
2021-12-29
Yes
GP139
GPR139
A orphans
A
Human
cryo-EM
7VUJ
-
3.8
R
Active
100
79
Gs
αs
-
58
-
Nanobody-35
JNJ-63533054
small-molecule
Agonist
L-tryptophan, L-phenylalanine
small-molecule
Yes
No
Zhou Y, Daver H, Trapkov B, Wu L, Wu M, Harpsoe K, Gentry PR, Liu K, Larionova M, Liu J, Chen N, Brauner-Osborne H, Gloriam DE, Hua T, Liu ZJ
10.1038/S41422-021-00591-W
2021-12-29
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7S1M
7S1M_refined
2.4
R
Active
100
82
Gs
αs
-
59
-
Nanobody-35
exendin-4
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cary BP, Deganutti G, Zhao P, Truong TT, Piper SJ, Liu X, Belousoff MJ, Danev R, Sexton PM, Wootten D, Gellman SH
10.1038/S41589-021-00945-W
2022-01-05
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7S3I
-
2.5
R
Active
100
57
Gs
αs
-
59
-
Nanobody-35
exendin-4
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cary BP, Deganutti G, Zhao P, Truong TT, Piper SJ, Liu X, Belousoff MJ, Danev R, Sexton PM, Wootten D, Gellman SH
10.1038/S41589-021-00945-W
2022-01-05
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EO2
7EO2_refined
2.9
A
Active
100
73
Gi/o
αi1
-
62
-
scFv16
(S)-FTY720-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Xu Z, Ikuta T, Kawakami K, Kise R, Qian Y, Xia R, Sun MX, Zhang A, Guo C, Cai XH, Huang Z, Inoue A, He Y
10.1038/S41589-021-00930-3
2022-01-05
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EO4
7EO4_refined
2.9
A
Active
100
74
Gi/o
αi1
-
43
-
scFv16
siponimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Xu Z, Ikuta T, Kawakami K, Kise R, Qian Y, Xia R, Sun MX, Zhang A, Guo C, Cai XH, Huang Z, Inoue A, He Y
10.1038/S41589-021-00930-3
2022-01-05
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7WF7
7WF7_refined
3.4
A
Active
100
71
Gi/o
αi1
-
40
-
scFv16
sphingosine 1-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Xu Z, Ikuta T, Kawakami K, Kise R, Qian Y, Xia R, Sun MX, Zhang A, Guo C, Cai XH, Huang Z, Inoue A, He Y
10.1038/S41589-021-00930-3
2022-01-05
Yes
ADA1B
α1B
Adrenoceptors
A
Human
X-ray
7B6W
-
2.9
A
Inactive
1
51
-
-
-
-
DARPin D12
-
(+)-cyclazosin
small-molecule
Inverse agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Deluigi M, Morstein L, Schuster M, Klenk C, Merklinger L, Cridge RR, de Zhang LA, Klipp A, Vacca S, Vaid TM, Mittl PRE, Egloff P, Eberle SA, Zerbe O, Chalmers DK, Scott DJ, Pluckthun A
10.1038/s41467-021-27911-3
2022-01-12
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC4
7WC4_refined
3.2
A
Inactive
1
61
-
-
-
-
BRIL
-
5-hydroxytryptamine
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC6
7WC6_refined
2.6
A
Inactive
1
58
-
-
-
-
BRIL
-
Lysergide
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC5
7WC5_refined
3.2
A
Inactive
1
60
-
-
-
-
BRIL
-
psilocin
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC7
7WC7_refined
2.6
A
Inactive
1
59
-
-
-
-
BRIL
-
lisuride
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC8
7WC8_refined
2.5
A
Inactive
1
59
-
-
-
-
BRIL
-
LUMATEPERONE
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
X-ray
7WC9
7WC9_refined
2.5
A
Inactive
1
59
-
-
-
-
BRIL
-
(10~{R},15~{S})-12-[3-(2-methoxyphenyl)propyl]-4-methyl-1,4,12-triazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-5(16),6,8-triene
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
No
No
Cao D, Yu J, Wang H, Luo Z, Liu X, He L, Qi J, Fan L, Tang L, Chen Z, Li J, Cheng J, Wang S
10.1126/SCIENCE.ABL8615
2022-01-26
Yes
GHSR
ghrelin
Ghrelin
A
Human
X-ray
7F83
7F83_refined
2.9
A
Inactive
13
78
-
-
-
-
BRIL
-
PF-05190457
small-molecule
Inverse agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
No
No
Qin J, Cai Y, Xu Z, Ming Q, Ji SY, Wu C, Zhang H, Mao C, Shen DD, Hirata K, Ma Y, Yan W, Zhang Y, Shao Z
10.1038/S41467-022-27975-9
2022-01-19
Yes
GHSR
ghrelin
Ghrelin
A
Human
cryo-EM
7W2Z
7W2Z_refined
2.8
R
Active
100
82
Gi/o
αo
-
60
-
scFv16
Ghrelin
peptide
Agonist
ghrelin, [des-Gln14 ]ghrelin
peptide
Yes
No
Qin J, Cai Y, Xu Z, Ming Q, Ji SY, Wu C, Zhang H, Mao C, Shen DD, Hirata K, Ma Y, Yan W, Zhang Y, Shao Z
10.1038/S41467-022-27975-9
2022-01-19
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7LLL
7LLL_refined
3.7
R
Active
100
79
Gs
αs
-
59
-
Nanobody-35
exendin-4
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Deganutti G, Liang YL, Zhang X, Khoshouei M, Clydesdale L, Belousoff MJ, Venugopal H, Truong TT, Glukhova A, Keller AN, Gregory KJ, Leach K, Christopoulos A, Danev R, Reynolds CA, Zhao P, Sexton PM, Wootten D
10.1038/S41467-021-27760-0
2022-01-12
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7LLY
7LLY_refined
3.3
R
Active
100
77
Gs
αs
-
50
-
Nanobody-35
Pro-glucagon
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Deganutti G, Liang YL, Zhang X, Khoshouei M, Clydesdale L, Belousoff MJ, Venugopal H, Truong TT, Glukhova A, Keller AN, Gregory KJ, Leach K, Christopoulos A, Danev R, Reynolds CA, Zhao P, Sexton PM, Wootten D
10.1038/S41467-021-27760-0
2022-01-12
Yes
US28
US28
Unclassified
A
strain AD169
cryo-EM
7RKF
-
4.0
R
Active
100
84
Gq/11
α11
-
96
-
scFv16
Fractalkine
peptide
Agonist
-
-
Yes
No
Tsutsumi N, Maeda S, Qu Q, Vogele M, Jude KM, Suomivuori CM, Panova O, Waghray D, Kato HE, Velasco A, Dror RO, Skiniotis G, Kobilka BK, Garcia KC
10.1126/SCIADV.ABL5442
2022-01-26
Yes
US28
US28
Unclassified
A
strain AD169
cryo-EM
7RKM
7RKM_refined
3.5
R
Active
100
83
Gi/o
αi1
-
61
-
scFv16
Fractalkine
peptide
Agonist
-
-
Yes
No
Tsutsumi N, Maeda S, Qu Q, Vogele M, Jude KM, Suomivuori CM, Panova O, Waghray D, Kato HE, Velasco A, Dror RO, Skiniotis G, Kobilka BK, Garcia KC
10.1126/SCIADV.ABL5442
2022-01-26
Yes
US28
US28
Unclassified
A
strain AD169
cryo-EM
7RKN
7RKN_refined
3.6
R
Active
100
83
Gi/o
αi1
-
61
-
scFv16
Fractalkine
peptide
Agonist
-
-
Yes
No
Tsutsumi N, Maeda S, Qu Q, Vogele M, Jude KM, Suomivuori CM, Panova O, Waghray D, Kato HE, Velasco A, Dror RO, Skiniotis G, Kobilka BK, Garcia KC
10.1126/SCIADV.ABL5442
2022-01-26
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7SIL
7SIL_refined
2.7
A
Active
-
72
-
-
-
-
-
-
tecalcet
Cyclomethyltryptophan
small-molecule small-molecule
Agonist
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Park J, Zuo H, Frangaj A, Fu Z, Yen LY, Zhang Z, Mosyak L, Slavkovich VN, Liu J, Ray KM, Cao B, Vallese F, Geng Y, Chen S, Grassucci R, Dandey VP, Tan YZ, Eng E, Lee Y, Kloss B, Liu Z, Hendrickson WA, Potter CS, Carragher B, Graziano J, Conigrave AD, Frank J, Clarke OB, Fan QR
10.1073/PNAS.2115849118
2022-01-19
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7SIN
7SIN_refined
5.9
A
Inactive
-
74
-
-
-
-
-
-
NPS 2143
small-molecule
Antagonist
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Park J, Zuo H, Frangaj A, Fu Z, Yen LY, Zhang Z, Mosyak L, Slavkovich VN, Liu J, Ray KM, Cao B, Vallese F, Geng Y, Chen S, Grassucci R, Dandey VP, Tan YZ, Eng E, Lee Y, Kloss B, Liu Z, Hendrickson WA, Potter CS, Carragher B, Graziano J, Conigrave AD, Frank J, Clarke OB, Fan QR
10.1073/PNAS.2115849118
2022-01-19
Yes
CASR
CaS
Calcium-sensing
C
Human
cryo-EM
7SIM
7SIM_refined
2.7
A
Active
-
72
-
-
-
-
-
-
Cyclomethyltryptophan
small-molecule
Agonist
L-tryptophan, Ca2+ , spermine, Mg2+
small-molecule
No
No
Park J, Zuo H, Frangaj A, Fu Z, Yen LY, Zhang Z, Mosyak L, Slavkovich VN, Liu J, Ray KM, Cao B, Vallese F, Geng Y, Chen S, Grassucci R, Dandey VP, Tan YZ, Eng E, Lee Y, Kloss B, Liu Z, Hendrickson WA, Potter CS, Carragher B, Graziano J, Conigrave AD, Frank J, Clarke OB, Fan QR
10.1073/PNAS.2115849118
2022-01-19
Yes
GHRHR
GHRH
Glucagon
B1
Human
cryo-EM
7V9M
7V9M_refined
3.3
R
Active
100
63
Gs
αs
-
57
-
Nanobody-35
Somatoliberin
peptide
Agonist
GHRH
peptide
No
No
-
-
2021-10-20
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EVY
7EVY_refined
3.0
D
Active
100
71
Gi/o
αi1
-
64
-
scFv16
siponimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yuan Y, Jia G, Wu C, Wang W, Cheng L, Li Q, Li Z, Luo K, Yang S, Yan W, Su Z, Shao Z
10.1038/S41422-021-00566-X
2021-09-29
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EVZ
7EVZ_refined
3.1
D
Active
100
71
Gi/o
αi1
-
64
-
scFv16
cenerimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yuan Y, Jia G, Wu C, Wang W, Cheng L, Li Q, Li Z, Luo K, Yang S, Yan W, Su Z, Shao Z
10.1038/S41422-021-00566-X
2021-09-29
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW0
7EW0_refined
3.4
D
Active
100
71
Gi/o
αi1
-
64
-
scFv16
ozanimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yuan Y, Jia G, Wu C, Wang W, Cheng L, Li Q, Li Z, Luo K, Yang S, Yan W, Su Z, Shao Z
10.1038/S41422-021-00566-X
2021-09-29
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7EW7
7EW7_refined
3.3
D
Active
100
75
Gi/o
αi1
-
64
-
scFv16
SEW2871
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yuan Y, Jia G, Wu C, Wang W, Cheng L, Li Q, Li Z, Luo K, Yang S, Yan W, Su Z, Shao Z
10.1038/S41422-021-00566-X
2021-09-29
Yes
MSHR
MC1
Melanocortin
A
Human
cryo-EM
7F4D
7F4D_refined
3.0
R
Active
100
83
Gs
αs
-
59
-
Nanobody-35
INTERMEDINE
protein
Agonist
β-MSH, α-MSH, γ-MSH, ACTH
peptide
Yes
No
Ma S, Chen Y, Dai A, Yin W, Guo J, Yang D, Zhou F, Jiang Y, Wang MW, Xu HE
10.1038/S41422-021-00557-Y
2021-09-08
Yes
MSHR
MC1
Melanocortin
A
Human
cryo-EM
7F4F
7F4F_refined
2.9
R
Active
100
85
Gs
αs
-
59
-
scFv16
CHEMBL407070
protein
Agonist
β-MSH, α-MSH, γ-MSH, ACTH
peptide
Yes
No
Ma S, Chen Y, Dai A, Yin W, Guo J, Yang D, Zhou F, Jiang Y, Wang MW, Xu HE
10.1038/S41422-021-00557-Y
2021-09-08
Yes
MSHR
MC1
Melanocortin
A
Human
cryo-EM
7F4H
7F4H_refined
2.7
R
Active
100
84
Gs
αs
-
59
-
Nanobody-35 scFv16
CHEMBL407070
protein
Agonist
β-MSH, α-MSH, γ-MSH, ACTH
peptide
Yes
No
Ma S, Chen Y, Dai A, Yin W, Guo J, Yang D, Zhou F, Jiang Y, Wang MW, Xu HE
10.1038/S41422-021-00557-Y
2021-09-08
Yes
MSHR
MC1
Melanocortin
A
Human
cryo-EM
7F4I
7F4I_refined
3.1
R
Active
100
84
Gs
αs
-
59
-
Nanobody-35
bremelanotide
peptide
Agonist
β-MSH, α-MSH, γ-MSH, ACTH
peptide
Yes
No
Ma S, Chen Y, Dai A, Yin W, Guo J, Yang D, Zhou F, Jiang Y, Wang MW, Xu HE
10.1038/S41422-021-00557-Y
2021-09-08
Yes
AGTR2
AT2
Angiotensin
A
Human
X-ray
7JNI
7JNI_refined
3.0
A
Active
99
82
-
-
-
-
BRIL
-
olodanrigan
small-molecule
Antagonist
angiotensin-(1-7), angiotensin II, angiotensin III
peptide
Yes
No
-
-
2022-02-09
Yes
FPR1
FPR1
Formylpeptide
A
Human
cryo-EM
7T6T
7T6T_refined
3.2
R
Active
100
85
Gi/o
αi1
-
61
-
-
synthetic peptide
peptide
Agonist
fMet-Leu-Phe, annexin I, spinorphin, cathepsin G
peptide
Yes
No
-
-
2022-03-30
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7T6S
7T6S_refined
3.0
R
Active
100
85
Gi/o
αi1
-
61
-
scFv16
N-(4-chlorophenyl)-N'-[1-methyl-3-oxo-2-phenyl-5-(propan-2-yl)-2,3-dihydro-1H-pyrazol-4-yl]urea
small-molecule
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
-
-
2022-03-30
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7T6U
7T6U_refined
2.9
R
Active
100
85
Gi/o
αi1
-
62
-
-
synthetic peptide
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
-
-
2022-03-30
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7T6V
7T6V_refined
3.1
R
Active
100
85
Gi/o
αi1
-
61
-
scFv16
synthetic peptide
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
-
-
2022-03-30
Yes
NPY1R
Y1
Neuropeptide Y
A
Human
cryo-EM
7VGX
7VGX_refined
3.2
R
Active
100
73
Gi/o
αi1
-
63
-
scFv16
neuropeptide Y
peptide
Agonist
pancreatic polypeptide, neuropeptide Y, peptide YY
peptide
Yes
No
Park C, Kim J, Ko SB, Choi YK, Jeong H, Woo H, Kang H, Bang I, Kim SA, Yoon TY, Seok C, Im W, Choi HJ
10.1038/S41467-022-28510-6
2022-02-23
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7T10
7T10_refined
2.5
R
Active
100
78
Gi/o
αi3
-
62
-
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Robertson MJ, Meyerowitz JG, Panova O, Borrelli K, Skiniotis G
10.1038/S41594-022-00727-5
2022-03-09
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7T11
7T11_refined
2.7
R
Active
100
77
Gi/o
αi3
-
62
-
scFv16
Octreotide
peptide
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Robertson MJ, Meyerowitz JG, Panova O, Borrelli K, Skiniotis G
10.1038/S41594-022-00727-5
2022-03-09
Yes
OXYR
OT
Vasopressin and oxytocin
A
Human
cryo-EM
7RYC
-
2.9
O
Active
100
73
Gq/11
αq
Gamma subunit fused to alpha subunit
57
-
scFv16
oxytocin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Meyerowitz JG, Robertson MJ, Barros-Alvarez X, Panova O, Nwokonko RM, Gao Y, Skiniotis G
10.1038/S41594-022-00728-4
2022-03-09
Yes
CCR1
CCR1
Chemokine
A
Human
cryo-EM
7VL8
7VL8_refined
2.9
R
Active
100
80
Gi/o
αi1
-
62
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
CCL14, CCL5, CCL4, CCL23, CCL3, CCL13, CCL8, CCL7, CCL15, CCL16
peptide
No
No
Shao Z, Shen Q, Yao B, Mao C, Chen LN, Zhang H, Shen DD, Zhang C, Li W, Du X, Li F, Ma H, Chen ZH, Xu HE, Ying S, Zhang Y, Shen H
10.1038/S41589-021-00918-Z
2022-03-23
Yes
CCR1
CCR1
Chemokine
A
Human
cryo-EM
7VL9
7VL9_refined
2.6
R
Active
100
85
Gi/o
αi1
-
62
-
scFv16
CCL15(26-92)
peptide
Agonist
CCL14, CCL5, CCL4, CCL23, CCL3, CCL13, CCL8, CCL7, CCL15, CCL16
peptide
No
No
Shao Z, Shen Q, Yao B, Mao C, Chen LN, Zhang H, Shen DD, Zhang C, Li W, Du X, Li F, Ma H, Chen ZH, Xu HE, Ying S, Zhang Y, Shen H
10.1038/S41589-021-00918-Z
2022-03-23
Yes
CCR1
CCR1
Chemokine
A
Human
cryo-EM
7VLA
7VLA_refined
2.7
R
Active
100
85
Gi/o
αi1
-
64
-
scFv16
CCL15(27-92)
peptide
Agonist
CCL14, CCL5, CCL4, CCL23, CCL3, CCL13, CCL8, CCL7, CCL15, CCL16
peptide
No
No
Shao Z, Shen Q, Yao B, Mao C, Chen LN, Zhang H, Shen DD, Zhang C, Li W, Du X, Li F, Ma H, Chen ZH, Xu HE, Ying S, Zhang Y, Shen H
10.1038/S41589-021-00918-Z
2022-03-23
Yes
LT4R1
BLT1
Leukotriene
A
Human
cryo-EM
7VKT
7VKT_refined
2.9
A
Active
100
82
Gi/o
αi1
-
64
-
scFv16
LTB4
small-molecule
Agonist
LTB4 , 20-hydroxy-LTB4 , 12R-HETE
small-molecule
Yes
No
Wang N, He X, Zhao J, Jiang H, Cheng X, Xia Y, Eric Xu H, He Y
10.1038/S41467-022-28820-9
2022-03-09
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7TD0
7TD0_refined
2.8
R
Active
100
80
Gi/o
αi1
-
62
-
-
(2r)-2-Hydroxy-3-(Phosphonooxy)propyl (9e)-Octadec-9-Enoate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Liu S, Paknejad N, Zhu L, Kihara Y, Ray M, Chun J, Liu W, Hite RK, Huang XY
10.1038/S41467-022-28417-2
2022-02-09
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7TD1
7TD1_refined
3.1
R
Active
100
80
Gi/o
αi1
-
62
-
-
(2r)-2-Hydroxy-3-(Phosphonooxy)propyl (9e)-Octadec-9-Enoate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Liu S, Paknejad N, Zhu L, Kihara Y, Ray M, Chun J, Liu W, Hite RK, Huang XY
10.1038/S41467-022-28417-2
2022-02-09
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7TD2
7TD2_refined
3.1
R
Active
100
80
Gi/o
αi1
-
62
-
-
(2r)-2-Hydroxy-3-(Phosphonooxy)propyl (9e)-Octadec-9-Enoate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Liu S, Paknejad N, Zhu L, Kihara Y, Ray M, Chun J, Liu W, Hite RK, Huang XY
10.1038/S41467-022-28417-2
2022-02-09
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7TD3
7TD3_refined
3.0
R
Active
100
76
Gi/o
αi1
-
63
-
-
sphingosine 1-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Liu S, Paknejad N, Zhu L, Kihara Y, Ray M, Chun J, Liu W, Hite RK, Huang XY
10.1038/S41467-022-28417-2
2022-02-09
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7TD4
7TD4_refined
2.6
R
Active
100
76
Gi/o
αi1
-
63
-
-
siponimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Liu S, Paknejad N, Zhu L, Kihara Y, Ray M, Chun J, Liu W, Hite RK, Huang XY
10.1038/S41467-022-28417-2
2022-02-09
Yes
MTR1A
MT1
Melatonin
A
Human
cryo-EM
7VGZ
7VGZ_refined
3.3
B
Active
100
81
Gi/o
αi1
-
62
-
scFv16
ramelteon
small-molecule
Agonist
melatonin
small-molecule
Yes
No
-
-
2022-03-02
Yes
MTR1A
MT1
Melatonin
A
Human
cryo-EM
7VGY
7VGY_refined
3.1
A
Active
100
80
Gi/o
αi1
-
62
-
scFv16
2-iodo-melatonin
small-molecule
Agonist
melatonin
small-molecule
Yes
No
-
-
2022-03-02
Yes
MTR1B
MT2
Melatonin
A
Human
cryo-EM
7VH0
7VH0_refined
3.5
A
Active
100
75
Gi/o
αi1
-
61
-
scFv16
ramelteon
small-molecule
Agonist
melatonin
small-molecule
Yes
No
-
-
2022-03-02
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
7PX4
7PX4_refined
2.3
A
Inactive
1
72
-
-
-
-
BRIL
-
Preladenant conjugate PSB-2113
small-molecule
Antagonist
adenosine
small-molecule
No
No
Claff T, Klapschinski TA, Tiruttani Subhramanyam UK, Vaassen VJ, Schlegel JG, Vielmuth C, Voss JH, Labahn J, Muller CE
10.1002/ANIE.202115545
2022-03-02
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
7PYR
7PYR_refined
2.6
A
Inactive
1
72
-
-
-
-
BRIL
-
Preladenant conjugate PSB-2115
small-molecule
Antagonist
adenosine
small-molecule
No
No
Claff T, Klapschinski TA, Tiruttani Subhramanyam UK, Vaassen VJ, Schlegel JG, Vielmuth C, Voss JH, Labahn J, Muller CE
10.1002/ANIE.202115545
2022-03-02
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYF
-
2.2
R
Active
100
77
Gs
αs
-
58
-
Nanobody-35 RAMP1
amylin peptide
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYH
7TYH_refined
3.3
R
Active
100
78
Gs
αs
-
58
-
Nanobody-35
Calcitonin human
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYI
7TYI_refined
3.3
R
Active
100
77
Gs
αs
-
58
-
Nanobody-35
Amylin rat
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-30
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYL
7TYL_refined
3.3
R
Active
100
78
Gs
αs
-
58
-
Nanobody-35
Amylin rat
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYN
7TYN_refined
2.6
R
Active
100
79
Gs
αs
-
58
-
Nanobody-35
Calcitonin salmon
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-30
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYO
7TYO_refined
2.7
R
Active
100
76
Gs
αs
-
58
-
Nanobody-35
Calcitonin human
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYW
7TYW_refined
3.0
R
Active
100
78
Gs
αs
-
58
-
Nanobody-35
Calcitonin salmon
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYX
-
2.6
R
Active
100
77
Gs
αs
-
59
-
Nanobody-35
Amylin rat
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-30
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TYY
7TYY_refined
3.0
R
Active
100
78
Gs
αs
-
58
-
Nanobody-35
Calcitonin salmon
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
CALCR
CT
Calcitonin
B1
Human
cryo-EM
7TZF
-
2.4
R
Active
100
77
Gs
αs
-
59
-
Nanobody-35 RAMP3
amylin peptide
peptide
Agonist
amylin, calcitonin, adrenomedullin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP
peptide
No
No
-
-
2022-03-23
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7FIN
7FIN_refined
3.1
R
Active
100
82
Gs
αs
-
59
-
Nanobody-35
Peptide-20
peptide
Agonist
gastric inhibitory polypeptide
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-02-23
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7FIY
7FIY_refined
3.4
R
Active
100
77
Gs
αs
-
60
-
Nanobody-35
tirzepatide
peptide
Agonist
gastric inhibitory polypeptide
peptide
No
No
-
-
2022-03-02
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7VAB
7VAB_refined
3.2
R
Active
100
58
Gs
αs
Mini-Gs
60
-
Nanobody-35
tirzepatide
peptide
Agonist
gastric inhibitory polypeptide
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-03-02
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7FIM
7FIM_refined
3.4
R
Active
100
83
Gs
αs
-
57
-
Nanobody-35
tirzepatide
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-03-02
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7VBI
7VBI_refined
3.0
R
Active
100
83
Gs
αs
Mini-Gs
58
-
-
tirzepatide
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-03-02
Yes
GLR
glucagon
Glucagon
B1
Human
cryo-EM
7V35
7V35_refined
3.4
R
Active
100
82
Gs
αs
-
53
-
Nanobody-35
Peptide-20
peptide
Agonist
glucagon
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-03-02
Yes
GRM3
mGlu3
Metabotropic glutamate
C
Human
cryo-EM
7WI6
7WI6_refined
3.7
A
Inactive
-
82
-
-
-
-
-
-
LY341495
small-molecule
Antagonist
NAAG, L-glutamic acid
small-molecule
No
No
Fang W, Yang F, Xu C, Ling S, Lin L, Zhou Y, Sun W, Wang X, Liu P, Rondard P, Shi P, Pin JP, Tian C, Liu J
10.1038/S41422-022-00623-Z
2022-03-16
Yes
GRM3
mGlu3
Metabotropic glutamate
C
Human
cryo-EM
7WI8
7WI8_refined
4.2
A
Inactive
-
82
-
-
-
-
-
-
LY341495
small-molecule
Antagonist
NAAG, L-glutamic acid
small-molecule
No
No
Fang W, Yang F, Xu C, Ling S, Lin L, Zhou Y, Sun W, Wang X, Liu P, Rondard P, Shi P, Pin JP, Tian C, Liu J
10.1038/S41422-022-00623-Z
2022-03-16
Yes
GRM3
mGlu3
Metabotropic glutamate
C
Human
cryo-EM
7WIH
7WIH_refined
3.7
A
Active
-
84
-
-
-
-
-
-
CHEMBL4081453
small-molecule
Agonist
NAAG, L-glutamic acid
small-molecule
No
No
Fang W, Yang F, Xu C, Ling S, Lin L, Zhou Y, Sun W, Wang X, Liu P, Rondard P, Shi P, Pin JP, Tian C, Liu J
10.1038/S41422-022-00623-Z
2022-03-16
Yes
GPR88
GPR88
A orphans
A
Human
cryo-EM
7EJX
7EJX_refined
2.4
R
Active
100
60
Gi/o
αi1
-
61
-
scFv16
compound 2 [PMID: 24793972]
small-molecule
PAM
-
-
Yes
No
-
-
2022-04-13
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7WIC
7WIC_refined
2.8
R
Active
100
78
Gi/o
αi1
-
64
-
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Chen LN, Wang WW, Dong YJ, Shen DD, Guo J, Yu X, Qin J, Ji SY, Zhang H, Shen Q, He Q, Yang B, Zhang Y, Li Q, Mao C
10.1038/S41422-022-00669-Z
2022-06-01
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7X8R
-
2.6
R
Active
100
64
Gs
αs
-
59
-
Nanobody-35
CHEMBL449327
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Zhou Q, Li Y, Chen LN, Zhang ZC, Liang A, Liu Q, Wu X, Dai A, Xia T, Wu W, Zhang Y, Yang D, Wang MW
10.1073/PNAS.2200155119
2022-06-29
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7EJ0
7EJ0_refined
3.2
R
Active
100
56
Gi/o
αo
-
61
-
scFv16
(-)-noradrenaline
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2022-04-13
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7SBF
7SBF_refined
2.9
R
Active
100
71
Gi/o
αi1
-
61
BRIL
scFv16
N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-N'-[(2S)-1-(thiophen-3-yl)propan-2-yl]urea
small-molecule
Agonist
-
-
Yes
No
Wang H, Hetzer F, Huang W, Qu Q, Meyerowitz J, Kaindl J, Hubner H, Skiniotis G, Kobilka BK, Gmeiner P
10.1002/ANIE.202200269
2022-04-20
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7S15
7S15_refined
3.8
R
Active
93
83
-
-
-
-
-
-
2-[(4-{6-[(2,4-difluorophenyl)methoxy]pyridin-2-yl}piperidin-1-yl)methyl]-1-[(1-ethyl-1H-imidazol-5-yl)methyl]-1H-benzimidazole-6-carboxylic acid
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Griffith DA, Edmonds DJ, Fortin JP, Kalgutkar AS, Kuzmiski JB, Loria PM, Saxena AR, Bagley SW, Buckeridge C, Curto JM, Derksen DR, Dias JM, Griffor MC, Han S, Jackson VM, Landis MS, Lettiere D, Limberakis C, Liu Y, Mathiowetz AM, Patel JC, Piotrowski DW, Price DA, Ruggeri RB, Tess DA
10.1021/ACS.JMEDCHEM.1C01856
2022-06-08
Yes
GALR2
GAL2
Galanin
A
Human
cryo-EM
7XJK
-
3.3
F
Active
100
72
Gq/11
αq
-
63
-
scFv16
Galanin, Human
peptide
Agonist
galanin-like peptide, spexin-1, galanin
peptide
Yes
No
Jiang W, Zheng S
10.1073/PNAS.2121465119
2022-06-29
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7EJ8
7EJ8_refined
3.0
R
Active
100
57
Gi/o
αo
-
61
-
scFv16
brimonidine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2022-04-13
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
7EZC
7EZC_refined
3.8
B
Active
74
70
-
-
-
-
BRIL
-
UK-432,097
small-molecule
Agonist
adenosine
small-molecule
Yes
No
Cui M, Zhou Q, Xu Y, Weng Y, Yao D, Zhao S, Song G
10.1107/S2052252522001907
2022-04-13
Yes
VIPR2
VPAC2
VIP and PACAP
B1
Human
cryo-EM
7WBJ
7WBJ_refined
3.4
R
Active
100
82
Gs
αs
-
60
-
Nanobody-35
PACAP-27
peptide
Agonist
PACAP-27, secretin, GHRH, PACAP-38, VIP, PHI
peptide
No
No
Xu Y, Feng W, Zhou Q, Liang A, Li J, Dai A, Zhao F, Yan J, Chen CW, Li H, Zhao LH, Xia T, Jiang Y, Xu HE, Yang D, Wang MW
10.1038/S41467-022-30041-Z
2022-05-18
Yes
5HT2A
5-HT2A
5-Hydroxytryptamine
A
Human
cryo-EM
7RAN
-
3.5
A
Active
100
57
Gq/11
αq
Gi2-mini-Gq chimera
65
-
scFv16
3-[(3R)-3-methyl-1,2,3,6-tetrahydropyridin-1-ium-5-yl]-1H-pyrrolo[2,3-b]pyridine
small-molecule
Agonist
tryptamine, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-07-06
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7EJA
7EJA_refined
3.6
R
Active
100
58
Gi/o
αo
-
59
-
scFv16
dexmedetomidine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2022-04-13
Yes
AGRD1
ADGRD1
ADGRD
B2
Human
cryo-EM
7WU2
-
2.8
R
Active
100
32
Gs
αs
Mini-Gs
52
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qu X, Qiu N, Wang M, Zhang B, Du J, Zhong Z, Xu W, Chu X, Ma L, Yi C, Han S, Shui W, Zhao Q, Wu B
10.1038/S41586-022-04580-W
2022-04-27
Yes
AGRG5
ADGRG5
ADGRG
B2
Human
cryo-EM
7EQ1
-
3.3
R
Active
100
54
Gs
αs
-
56
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
-
-
2022-05-11
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7WIG
7WIG_refined
2.7
R
Active
100
77
Gi/o
αi1
-
64
-
scFv16
~{N}-[(2~{R})-1-[[(1~{R},3~{S})-3-(aminomethyl)cyclohexyl]methylamino]-3-(1~{H}-indol-3-yl)-1-oxidanylidene-propan-2-yl]spiro[indene-1,4'-piperidine]-1'-carboxamide
small-molecule
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Chen LN, Wang WW, Dong YJ, Shen DD, Guo J, Yu X, Qin J, Ji SY, Zhang H, Shen Q, He Q, Yang B, Zhang Y, Li Q, Mao C
10.1038/S41422-022-00669-Z
2022-06-01
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7EJK
7EJK_refined
3.4
R
Active
100
55
Gi/o
αo
-
61
-
scFv16
oxymetazoline
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
-
-
2022-04-13
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7SCG
7SCG_refined
3.0
D
Active
100
71
Gi/o
αi1
-
61
-
scFv16
(2E)-N-[(2S)-2-(dimethylamino)-3-(4-hydroxyphenyl)propyl]-3-(naphthalen-1-yl)prop-2-enamide
small-molecule
Agonist
-
-
Yes
No
Wang H, Hetzer F, Huang W, Qu Q, Meyerowitz J, Kaindl J, Hubner H, Skiniotis G, Kobilka BK, Gmeiner P
10.1002/ANIE.202200269
2022-04-20
Yes
BKRB2
B2
Bradykinin
A
Human
cryo-EM
7F6I
-
2.8
A
Active
100
78
Gq/11
αq
-
63
-
-
kallidin
peptide
Agonist
[Hyp3 ]bradykinin, [des-Arg10 ]kallidin, Lys-[Hyp3 ]-bradykinin, kallidin, T-kinin, [des-Arg9 ]bradykinin, bradykinin
peptide
Yes
No
-
-
2022-01-05
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7X8S
7X8S_refined
3.1
R
Active
100
65
Gs
αs
-
60
-
Nanobody-35
2,4-bis(3-methoxy-4-thiophen-2-ylcarbonyloxy-phenyl)-1,3-bis[[4-(2-methylpropanoylamino)phenyl]carbonylamino]cyclobutane-1,3-dicarboxylic acid
small-molecule
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Cong Z, Zhou Q, Li Y, Chen LN, Zhang ZC, Liang A, Liu Q, Wu X, Dai A, Xia T, Wu W, Zhang Y, Yang D, Wang MW
10.1073/PNAS.2200155119
2022-06-29
Yes
FPR1
FPR1
Formylpeptide
A
Human
cryo-EM
7WVU
7WVU_refined
3.3
R
Active
100
85
Gi/o
αi1
-
62
-
-
FME-LEU-PHE
peptide
Agonist
fMet-Leu-Phe, annexin I, spinorphin, cathepsin G
peptide
Yes
No
Zhu Y, Lin X, Zong X, Han S, Wang M, Su Y, Ma L, Chu X, Yi C, Zhao Q, Wu B
10.1038/S41467-022-29361-X
2022-04-13
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WU5
7WU5_refined
3.0
R
Active
100
31
Gi/o
αi1
Mini-Gi1
58
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qu X, Qiu N, Wang M, Zhang B, Du J, Zhong Z, Xu W, Chu X, Ma L, Yi C, Han S, Shui W, Zhao Q, Wu B
10.1038/S41586-022-04580-W
2022-04-27
Yes
NPY4R
Y4
Neuropeptide Y
A
Human
cryo-EM
7X9C
7X9C_refined
3.0
R
Active
100
81
Gi/o
αi1
-
61
-
-
Pancreatic polypeptide
peptide
Agonist
pancreatic polypeptide, PYY-(3-36), neuropeptide Y, peptide YY
peptide
Yes
No
Tang T, Tan Q, Han S, Diemar A, Lobner K, Wang H, Schuss C, Behr V, Morl K, Wang M, Chu X, Yi C, Keller M, Kofoed J, Reedtz-Runge S, Kaiser A, Beck-Sickinger AG, Zhao Q, Wu B
10.1126/SCIADV.ABM1232
2022-05-18
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7WVV
7WVV_refined
2.9
R
Active
100
85
Gi/o
αi2
-
63
BRIL
-
synthetic peptide
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Zhu Y, Lin X, Zong X, Han S, Wang M, Su Y, Ma L, Chu X, Yi C, Zhao Q, Wu B
10.1038/S41467-022-29361-X
2022-04-13
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7VBH
7VBH_refined
3.0
R
Active
100
83
Gs
αs
-
53
-
Nanobody-35
Peptide 20
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Zhao F, Zhou Q, Cong Z, Hang K, Zou X, Zhang C, Chen Y, Dai A, Liang A, Ming Q, Wang M, Chen LN, Xu P, Chang R, Feng W, Xia T, Zhang Y, Wu B, Yang D, Zhao L, Xu HE, Wang MW
10.1038/S41467-022-28683-0
2022-04-06
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7X2F
-
3.0
F
Active
100
63
Gs
αs
-
56
-
Nanobody-35
dopamine
LY3154207
small-molecule small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Teng X, Chen S, Nie Y, Xiao P, Yu X, Shao Z, Zheng S
10.1038/S41467-022-30929-W
2022-06-15
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7WVW
7WVW_refined
3.1
R
Active
100
85
Gi/o
αi2
-
63
BRIL
-
FME-TYR-PHE-ILE-ASN-ILE-LEU-THE-LEU
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Zhu Y, Lin X, Zong X, Han S, Wang M, Su Y, Ma L, Chu X, Yi C, Zhao Q, Wu B
10.1038/S41467-022-29361-X
2022-04-13
Yes
AGRL3
ADGRL3
ADGRL
B2
Human
cryo-EM
7SF7
-
2.9
A
Active
100
19
G12/13
α13
Gi2-mini-G13 chimera
54
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Barros-Alvarez X, Nwokonko RM, Vizurraga A, Matzov D, He F, Papasergi-Scott MM, Robertson MJ, Panova O, Yardeni EH, Seven AB, Kwarcinski FE, Su H, Peroto MC, Meyerowitz JG, Shalev-Benami M, Tall GG, Skiniotis G
10.1038/S41586-022-04575-7
2022-04-27
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
cryo-EM
7V6A
-
3.6
R
Active
100
58
Gi/o
αi1
-
62
-
scFv16
methyl 4-[4-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
-
-
2022-05-11
Yes
NTR1
NTS1
Neurotensin
A
Human
cryo-EM
7UL2
7UL2_refined
2.4
R
Inactive
3
69
-
-
-
-
-
Nanobody-6
meclinertant
small-molecule
Inverse agonist
large neuromedin N, neurotensin, neuromedin N, large neurotensin
peptide
Yes
No
-
-
2022-06-29
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7WVX
7WVX_refined
2.8
R
Active
100
85
Gi/o
αi2
-
61
BRIL
-
humanin
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Zhu Y, Lin X, Zong X, Han S, Wang M, Su Y, Ma L, Chu X, Yi C, Zhao Q, Wu B
10.1038/S41467-022-29361-X
2022-04-13
Yes
NMUR2
NMU2
Neuromedin U
A
Human
cryo-EM
7W57
-
3.2
R
Active
100
72
Gq/11
αq
-
59
-
scFv16
Neuromedin-S
peptide
Agonist
neuromedin S-33, neuromedin U-23, neuromedin U-25, neuromedin S-36
peptide
Yes
No
You C, Zhang Y, Xu P, Huang S, Yin W, Eric Xu H, Jiang Y
10.1038/S41467-022-29683-W
2022-04-20
Yes
FPR2
FPR2/ALX
Formylpeptide
A
Human
cryo-EM
7WVY
7WVY_refined
3.0
R
Active
100
85
Gi/o
αi2
-
63
BRIL
-
Amyloid beta-Peptide (1-42)
peptide
Agonist
LXA4 , fMet-Leu-Phe, LTD4 , PrP106-126 , aspirin triggered lipoxin A4, LL-37, serum amyloid A, humanin, 15-deoxy-LXA4, resolvin D1, aspirin-triggered resolvin D1, LTC4 , annexin I
peptide
Yes
No
Zhu Y, Lin X, Zong X, Han S, Wang M, Su Y, Ma L, Chu X, Yi C, Zhao Q, Wu B
10.1038/S41467-022-29361-X
2022-04-13
Yes
AGRD1
ADGRD1
ADGRD
B2
Human
cryo-EM
7EPT
-
3.0
R
Active
100
31
Gs
αs
-
53
-
Nanobody-35
-
-
-
-
-
No
No
Ping YQ, Xiao P, Yang F, Zhao RJ, Guo SC, Yan X, Wu X, Zhang C, Lu Y, Zhao F, Zhou F, Xi YT, Yin W, Liu FZ, He DF, Zhang DL, Zhu ZL, Jiang Y, Du L, Feng SQ, Schoneberg T, Liebscher I, Xu HE, Sun JP
10.1038/S41586-022-04619-Y
2022-05-11
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7F1O
-
3.1
F
Active
100
62
Gs
αs
-
60
-
Nanobody-35
dopamine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-06-15
Yes
5HT4R
5-HT4
5-Hydroxytryptamine
A
Human
cryo-EM
7XT9
7XT9_refined
3.2
R
Active
100
76
Gs
αs
-
60
BRIL
-
5-hydroxytryptamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Shen DD, Simon IA, Mao C, Tan Y, Zhang H, Harpsoe K, Li H, Zhang Y, You C, Yu X, Jiang Y, Zhang Y, Gloriam DE, Xu HE
10.1016/J.MOLCEL.2022.05.031
2022-07-27
Yes
GALR1
GAL1
Galanin
A
Human
cryo-EM
7WQ3
7WQ3_refined
2.7
R
Active
100
83
Gi/o
αi1
-
64
-
scFv16
galanin
peptide
Agonist
galanin-like peptide, galanin
peptide
Yes
No
-
-
2022-04-20
Yes
FPR1
FPR1
Formylpeptide
A
Human
cryo-EM
7EUO
7EUO_refined
2.9
R
Active
100
84
Gi/o
αi1
-
62
-
scFv16
Peptide Agonist fMLF
peptide
Agonist
fMet-Leu-Phe, annexin I, spinorphin, cathepsin G
peptide
Yes
No
-
-
2022-05-25
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7X2C
-
3.2
F
Active
100
63
Gs
αs
-
57
-
Nanobody-35
fenoldopam
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Teng X, Chen S, Nie Y, Xiao P, Yu X, Shao Z, Zheng S
10.1038/S41467-022-30929-W
2022-06-29
Yes
GALR2
GAL2
Galanin
A
Human
cryo-EM
7WQ4
7WQ4_refined
2.6
R
Active
100
73
Gq/11
αq
-
60
-
Nanobody-35
galanin
peptide
Agonist
galanin-like peptide, spexin-1, galanin
peptide
Yes
No
-
-
2022-04-20
Yes
OX2R
OX2
Orexin
A
Human
cryo-EM
7SQO
7SQO_refined
3.2
R
Active
100
61
Gi/o
αi1
-
61
-
scFv16
methyl (2R,3S)-3-[(methanesulfonyl)amino]-2-({[(1s,4S)-4-phenylcyclohexyl]oxy}methyl)piperidine-1-carboxylate
small-molecule
Agonist
orexin-A, orexin-B
peptide
Yes
No
-
-
2022-05-25
Yes
GALR2
GAL2
Galanin
A
Human
cryo-EM
7XJL
-
3.5
F
Active
100
72
Gq/11
αq
-
63
-
scFv16
Spexin
small-molecule
Agonist
galanin-like peptide, spexin-1, galanin
peptide
Yes
No
Jiang W, Zheng S
10.1073/PNAS.2121465119
2022-06-29
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7U2L
7U2L_refined
3.2
D
Active
100
71
Gi/o
αi1
-
61
-
scFv16
N-(5-carbamimidamidopentyl)-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
small-molecule
Agonist
-
-
Yes
No
-
-
2022-05-04
Yes
OX2R
OX2
Orexin
A
Human
cryo-EM
7SR8
-
3.3
R
Active
100
64
Gq/11
αq
-
63
-
scFv16
methyl (2R,3S)-3-[(methanesulfonyl)amino]-2-({[(1s,4S)-4-phenylcyclohexyl]oxy}methyl)piperidine-1-carboxylate
small-molecule
Agonist
orexin-A, orexin-B
peptide
Yes
No
Yin J, Kang Y, McGrath AP, Chapman K, Sjodt M, Kimura E, Okabe A, Koike T, Miyanohana Y, Shimizu Y, Rallabandi R, Lian P, Bai X, Flinspach M, De Brabander JK, Rosenbaum DM
10.1038/S41467-022-30601-3
2022-06-08
Yes
CNR1
CB1
Cannabinoid
A
Human
X-ray
7FEE
7FEE_refined
2.7
A
Inactive
9
61
-
-
-
-
GlgA glycogen synthase
-
CP55940
6-methyl-3-[(1S)-2-nitro-1-thiophen-2-yl-ethyl]-2-phenyl-1H-indole
small-molecule small-molecule
Agonist PAM
anandamide, 2-arachidonoylglycerol
small-molecule
No
No
Yang X, Wang X, Xu Z, Wu C, Zhou Y, Wang Y, Lin G, Li K, Wu M, Xia A, Liu J, Cheng L, Zou J, Yan W, Shao Z, Yang S
10.1038/S41589-022-01038-Y
2022-06-15
Yes
S1PR2
S1P2
Lysophospholipid (S1P)
A
Human
cryo-EM
7T6B
-
3.2
R
Active
100
75
G12/13
α13
-
60
-
scFv16
sphingosine 1-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
-
-
2022-04-06
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
cryo-EM
7V69
7V69_refined
3.4
R
Active
100
58
Gi/o
αi1
-
62
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
acetylcholine
small-molecule
Yes
No
-
-
2022-05-11
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7X2D
-
3.3
F
Active
100
63
Gs
αs
-
57
-
Nanobody-35
TAVAPADON
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
Teng X, Chen S, Nie Y, Xiao P, Yu X, Shao Z, Zheng S
10.1038/S41467-022-30929-W
2022-06-15
Yes
GP183
GPR183
A orphans
A
Human
cryo-EM
7TUY
7TUY_refined
3.0
R
Intermediate
42
73
-
-
-
-
BRIL
anti-BRIL Fab heavy chain anti-BRIL Fab light chain anti-Fab Nanobody
8-[(2E)-3-(4-chlorophenyl)prop-2-enoyl]-3-[(3,4-dichlorophenyl)methyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
small-molecule
Inverse agonist
7β, 27-dihydroxycholesterol, 7α,27-dihydroxycholesterol, 7α,25-dihydroxycholesterol, 7α-hydroxycholesterol, 7β-hydroxycholesterol, 7β, 25-dihydroxycholesterol, 25-hydroxycholesterol, 27-hydroxycholesterol
small-molecule
No
No
-
-
2022-04-13
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7WUQ
-
2.9
R
Active
100
28
Gs
αs
-
55
-
Nanobody-35
-
-
-
-
-
No
No
Xiao P, Guo S, Wen X, He QT, Lin H, Huang SM, Gou L, Zhang C, Yang Z, Zhong YN, Yang CC, Li Y, Gong Z, Tao XN, Yang ZS, Lu Y, Li SL, He JY, Wang C, Zhang L, Kong L, Sun JP, Yu X
10.1038/S41586-022-04590-8
2022-04-27
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7F0T
-
3.1
F
Active
100
63
Gs
αs
-
58
-
Nanobody-35
dopamine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-06-15
Yes
5HT4R
5-HT4
5-Hydroxytryptamine
A
Human
cryo-EM
7XT8
-
3.1
R
Active
100
76
Gs
αs
-
60
BRIL
Nanobody-35
5-hydroxytryptamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Shen DD, Simon IA, Mao C, Tan Y, Zhang H, Harpsoe K, Li H, Zhang Y, You C, Yu X, Jiang Y, Zhang Y, Gloriam DE, Xu HE
10.1016/J.MOLCEL.2022.05.031
2022-07-27
Yes
GP183
GPR183
A orphans
A
Human
cryo-EM
7TUZ
7TUZ_refined
3.1
R
Active
100
79
Gi/o
αi1
-
64
-
scFv16
(2S,4aS,4bS,7R,8S,8aS,9R,10aR)-7-[(2R,3R)-7-hydroxy-3,7-dimethyloctan-2-yl]-4a,7,8-trimethyltetradecahydrophenanthrene-2,9-diol
small-molecule
Agonist
7β, 27-dihydroxycholesterol, 7α,27-dihydroxycholesterol, 7α,25-dihydroxycholesterol, 7α-hydroxycholesterol, 7β-hydroxycholesterol, 7β, 25-dihydroxycholesterol, 25-hydroxycholesterol, 27-hydroxycholesterol
small-molecule
No
No
-
-
2022-04-13
Yes
BKRB2
B2
Bradykinin
A
Human
cryo-EM
7F6H
-
2.9
A
Active
100
78
Gq/11
αq
-
63
-
-
bradykinin
peptide
Agonist
[Hyp3 ]bradykinin, [des-Arg10 ]kallidin, Lys-[Hyp3 ]-bradykinin, kallidin, T-kinin, [des-Arg9 ]bradykinin, bradykinin
peptide
Yes
No
-
-
2022-01-05
Yes
SMO
SMO
Frizzled
F
Human
X-ray
7ZI0
7ZI0_refined
3.0
A
Inactive
4
61
-
-
-
-
BRIL
-
3-chloro-N-[trans-4-(methylamino)cyclohexyl]-N-{[3-(pyridin-4-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide
small-molecule
Antagonist
-
-
No
No
Kinnebrew M, Woolley RE, Ansell TB, Byrne EFX, Frigui S, Luchetti G, Sircar R, Nachtergaele S, Mydock-McGrane L, Krishnan K, Newstead S, Sansom MSP, Covey DF, Siebold C, Rohatgi R
10.1126/SCIADV.ABM5563
2022-06-15
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7RA3
7RA3_refined
3.2
R
Active
100
80
Gs
αs
Engineered G alpha
56
-
scFv16 Nanobody-35
gastric inhibitory polypeptide (human) - Incretin
peptide
Agonist
gastric inhibitory polypeptide
peptide
No
No
Sun B, Willard FS, Feng D, Alsina-Fernandez J, Chen Q, Vieth M, Ho JD, Showalter AD, Stutsman C, Ding L, Suter TM, Dunbar JD, Carpenter JW, Mohammed FA, Aihara E, Brown RA, Bueno AB, Emmerson PJ, Moyers JS, Kobilka TS, Coghlan MP, Kobilka BK, Sloop KW
10.1073/PNAS.2116506119
2022-04-13
Yes
GIPR
GIP
Glucagon
B1
Human
cryo-EM
7RBT
-
3.1
R
Active
100
81
Gs
αs
-
54
-
scFv16 Nanobody-35
tirzepatide
2-fluoro-4-[(1R)-6-methoxy-1-methyl-2-{(1S)-1-[4-(propan-2-yl)phenyl]ethyl}-1,2,3,4-tetrahydroisoquinolin-5-yl]-6-[(2-methylpropyl)amino]phenol
peptide small-molecule
Agonist PAM
gastric inhibitory polypeptide
peptide
No
No
Sun B, Willard FS, Feng D, Alsina-Fernandez J, Chen Q, Vieth M, Ho JD, Showalter AD, Stutsman C, Ding L, Suter TM, Dunbar JD, Carpenter JW, Mohammed FA, Aihara E, Brown RA, Bueno AB, Emmerson PJ, Moyers JS, Kobilka TS, Coghlan MP, Kobilka BK, Sloop KW
10.1073/PNAS.2116506119
2022-04-13
Yes
CNR1
CB1
Cannabinoid
A
Human
cryo-EM
7WV9
7WV9_refined
3.4
R
Active
100
61
Gi/o
αi2
-
63
-
scFv16
CP55940
6-methyl-3-[(1S)-2-nitro-1-thiophen-2-yl-ethyl]-2-phenyl-1H-indole
small-molecule small-molecule
Agonist PAM
anandamide, 2-arachidonoylglycerol
small-molecule
Yes
No
Yang X, Wang X, Xu Z, Wu C, Zhou Y, Wang Y, Lin G, Li K, Wu M, Xia A, Liu J, Cheng L, Zou J, Yan W, Shao Z, Yang S
10.1038/S41589-022-01038-Y
2022-06-15
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7RG9
-
3.2
R
Active
100
58
Gs
αs
-
54
-
scFv16 Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Sun B, Willard FS, Feng D, Alsina-Fernandez J, Chen Q, Vieth M, Ho JD, Showalter AD, Stutsman C, Ding L, Suter TM, Dunbar JD, Carpenter JW, Mohammed FA, Aihara E, Brown RA, Bueno AB, Emmerson PJ, Moyers JS, Kobilka TS, Coghlan MP, Kobilka BK, Sloop KW
10.1073/PNAS.2116506119
2022-04-13
Yes
NPY2R
Y2
Neuropeptide Y
A
Human
cryo-EM
7X9B
7X9B_refined
3.4
R
Active
100
79
Gi/o
αi1
-
62
-
-
neuropeptide Y
peptide
Agonist
neuropeptide Y-(3-36), PYY-(3-36), neuropeptide Y, peptide YY, pancreatic polypeptide
peptide
Yes
No
Tang T, Tan Q, Han S, Diemar A, Lobner K, Wang H, Schuss C, Behr V, Morl K, Wang M, Chu X, Yi C, Keller M, Kofoed J, Reedtz-Runge S, Kaiser A, Beck-Sickinger AG, Zhao Q, Wu B
10.1126/SCIADV.ABM1232
2022-05-18
Yes
GLP1R
GLP-1
Glucagon
B1
Human
cryo-EM
7RGP
-
2.9
R
Active
100
82
Gs
αs
Engineered G alpha
53
-
scFv16 Nanobody-35
tirzepatide
peptide
Agonist
glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide, glucagon
peptide
No
No
Sun B, Willard FS, Feng D, Alsina-Fernandez J, Chen Q, Vieth M, Ho JD, Showalter AD, Stutsman C, Ding L, Suter TM, Dunbar JD, Carpenter JW, Mohammed FA, Aihara E, Brown RA, Bueno AB, Emmerson PJ, Moyers JS, Kobilka TS, Coghlan MP, Kobilka BK, Sloop KW
10.1073/PNAS.2116506119
2022-04-13
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7UL4
7UL4_refined
2.8
A
Inactive
3
72
-
-
-
-
-
Megabody-6
alvimopan
small-molecule
Antagonist
-
-
Yes
No
-
-
2022-06-29
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WU3
-
3.1
R
Active
100
31
Gs
αs
Mini-Gs
52
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qu X, Qiu N, Wang M, Zhang B, Du J, Zhong Z, Xu W, Chu X, Ma L, Yi C, Han S, Shui W, Zhao Q, Wu B
10.1038/S41586-022-04580-W
2022-04-27
Yes
VIPR2
VPAC2
VIP and PACAP
B1
Human
cryo-EM
7VQX
7VQX_refined
2.7
R
Active
100
82
Gs
αs
-
60
-
Nanobody-35
PACAP-27
peptide
Agonist
PACAP-27, secretin, GHRH, PACAP-38, VIP, PHI
peptide
No
No
Xu Y, Feng W, Zhou Q, Liang A, Li J, Dai A, Zhao F, Yan J, Chen CW, Li H, Zhao LH, Xia T, Jiang Y, Xu HE, Yang D, Wang MW
10.1038/S41467-022-30041-Z
2022-05-18
Yes
5HT5A
5-HT5A
5-Hydroxytryptamine
A
Human
cryo-EM
7UM5
-
2.7
A
Active
100
75
Gi/o
αo
Mini-Go
58
-
scFv16
5-CT
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Zhang S, Chen H, Zhang C, Yang Y, Popov P, Liu J, Krumm BE, Cao C, Kim K, Xiong Y, Katritch V, Shoichet BK, Jin J, Fay JF, Roth BL
10.1038/S41594-022-00796-6
2022-07-20
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WU4
7WU4_refined
3.4
R
Active
100
31
Gi/o
αi1
Mini-Gi1
58
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qu X, Qiu N, Wang M, Zhang B, Du J, Zhong Z, Xu W, Chu X, Ma L, Yi C, Han S, Shui W, Zhao Q, Wu B
10.1038/S41586-022-04580-W
2022-04-27
Yes
ADRB3
β3
Adrenoceptors
A
Dog
cryo-EM
7XJI
7XJI_refined
3.9
R
Active
100
68
Gs
αs
-
59
-
Nanobody-35
3-[3-[2-[[(2~{S})-2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]ethylamino]phenyl]benzoic acid
small-molecule
Agonist
-
-
Yes
No
Nureki I, Kobayashi K, Tanaka T, Demura K, Inoue A, Shihoya W, Nureki O
10.1016/J.BBRC.2022.04.065
2022-05-04
Yes
TRFR
TRH1
Thyrotropin-releasing hormone
A
Human
cryo-EM
7WKD
7WKD_refined
3.0
R
Active
100
66
Gq/11
αq
-
60
-
scFv16
TRH
peptide
Agonist
TRH
peptide
Yes
No
Xu Y, Cai H, You C, He X, Yuan Q, Jiang H, Cheng X, Jiang Y, Xu HE
10.1038/S41422-022-00641-X
2022-06-15
Yes
AGRG1
ADGRG1
ADGRG
B2
Human
cryo-EM
7SF8
-
2.7
A
Active
100
37
G12/13
α13
Gi2-mini-G13 chimera
53
-
-
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Barros-Alvarez X, Nwokonko RM, Vizurraga A, Matzov D, He F, Papasergi-Scott MM, Robertson MJ, Panova O, Yardeni EH, Seven AB, Kwarcinski FE, Su H, Peroto MC, Meyerowitz JG, Shalev-Benami M, Tall GG, Skiniotis G
10.1038/S41586-022-04575-7
2022-04-27
Yes
NPY1R
Y1
Neuropeptide Y
A
Human
cryo-EM
7X9A
7X9A_refined
3.2
R
Active
100
80
Gi/o
αi1
-
61
-
-
neuropeptide Y
peptide
Agonist
pancreatic polypeptide, neuropeptide Y, peptide YY
peptide
Yes
No
Tang T, Tan Q, Han S, Diemar A, Lobner K, Wang H, Schuss C, Behr V, Morl K, Wang M, Chu X, Yi C, Keller M, Kofoed J, Reedtz-Runge S, Kaiser A, Beck-Sickinger AG, Zhao Q, Wu B
10.1126/SCIADV.ABM1232
2022-05-18
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7WUI
-
3.1
R
Active
100
24
Gs
αs
Mini-Gs
55
-
-
IP15
peptide
Agonist
-
-
No
No
Xiao P, Guo S, Wen X, He QT, Lin H, Huang SM, Gou L, Zhang C, Yang Z, Zhong YN, Yang CC, Li Y, Gong Z, Tao XN, Yang ZS, Lu Y, Li SL, He JY, Wang C, Zhang L, Kong L, Sun JP, Yu X
10.1038/S41586-022-04590-8
2022-04-27
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7F24
-
4.2
F
Active
100
62
Gs
αs
-
57
-
-
dopamine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-06-15
Yes
AGRG4
ADGRG4
ADGRG
B2
Human
cryo-EM
7WUJ
-
3.3
E
Active
100
9
Gs
αs
Mini-Gs
55
-
scFv16 Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Xiao P, Guo S, Wen X, He QT, Lin H, Huang SM, Gou L, Zhang C, Yang Z, Zhong YN, Yang CC, Li Y, Gong Z, Tao XN, Yang ZS, Lu Y, Li SL, He JY, Wang C, Zhang L, Kong L, Sun JP, Yu X
10.1038/S41586-022-04590-8
2022-04-27
Yes
ADRB3
β3
Adrenoceptors
A
Dog
cryo-EM
7XJH
7XJH_refined
3.3
R
Active
100
68
Gs
αs
-
59
-
Nanobody-35
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
-
-
2022-05-04
Yes
HRH2
H2
Histamine
A
Human
cryo-EM
7UL3
7UL3_refined
3.0
A
Inactive
3
75
-
-
-
-
-
Nanobody-6M NabFab HC NabFab LC
famotidine
small-molecule
Antagonist
histamine
small-molecule
Yes
No
-
-
2022-06-29
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
7S0G
-
3.9
R
Active
100
57
Gs
αs
Gi1-Gs chimera
56
-
-
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
Alegre KO, Paknejad N, Su M, Lou JS, Huang J, Jordan KD, Eng ET, Meyerson JR, Hite RK, Huang XY
10.1038/S41594-021-00679-2
2021-11-17
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7F1Z
-
3.5
F
Active
100
62
Gs
αs
-
60
-
-
dopamine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-06-15
Yes
5HT4R
5-HT4
5-Hydroxytryptamine
A
Human
cryo-EM
7XTA
7XTA_refined
3.2
R
Active
100
73
Gi/o
αi1
-
62
BRIL
scFv16
5-hydroxytryptamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Shen DD, Simon IA, Mao C, Tan Y, Zhang H, Harpsoe K, Li H, Zhang Y, You C, Yu X, Jiang Y, Zhang Y, Gloriam DE, Xu HE
10.1016/J.MOLCEL.2022.05.031
2022-07-27
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
7S0F
-
3.0
R
Active
100
56
Gi/o
αi1
-
63
-
-
LEVISOPRENALINE
small-molecule
Agonist
-
-
Yes
No
Alegre KO, Paknejad N, Su M, Lou JS, Huang J, Jordan KD, Eng ET, Meyerson JR, Hite RK, Huang XY
10.1038/S41594-021-00679-2
2021-11-17
Yes
DRD1
D1
Dopamine
A
Human
cryo-EM
7F23
-
3.6
F
Active
100
62
Gs
αs
-
60
-
Nanobody-35
dopamine
small-molecule
Agonist
(-)-noradrenaline, noradrenaline, dopamine, L-NOREPINEPHRINE, 5-hydroxytryptamine
small-molecule
Yes
No
-
-
2022-06-15
Yes
NMUR1
NMU1
Neuromedin U
A
Human
cryo-EM
7W53
-
3.2
R
Active
100
62
Gq/11
αq
-
54
-
scFv16
Neuromedin U-25 (human)
peptide
Agonist
neuromedin S-33, neuromedin U-23, neuromedin U-25, neuromedin S-36
peptide
Yes
No
You C, Zhang Y, Xu P, Huang S, Yin W, Eric Xu H, Jiang Y
10.1038/S41467-022-29683-W
2022-04-20
Yes
5HT5A
5-HT5A
5-Hydroxytryptamine
A
Human
X-ray
7UM4
7UM4_refined
2.8
A
Inactive
34
71
-
-
-
-
PGS
-
CHEMBL3654198
small-molecule
Antagonist
5-hydroxytryptamine
small-molecule
No
No
Zhang S, Chen H, Zhang C, Yang Y, Popov P, Liu J, Krumm BE, Cao C, Kim K, Xiong Y, Katritch V, Shoichet BK, Jin J, Fay JF, Roth BL
10.1038/S41594-022-00796-6
2022-07-20
Yes
NMUR2
NMU2
Neuromedin U
A
Human
cryo-EM
7W55
-
2.8
R
Active
100
73
Gq/11
αq
-
60
-
scFv16
Neuromedin U-25 (human)
peptide
Agonist
neuromedin S-33, neuromedin U-23, neuromedin U-25, neuromedin S-36
peptide
Yes
No
You C, Zhang Y, Xu P, Huang S, Yin W, Eric Xu H, Jiang Y
10.1038/S41467-022-29683-W
2022-04-20
Yes
NMUR1
NMU1
Neuromedin U
A
Human
cryo-EM
7W56
-
2.9
R
Active
100
65
Gq/11
αq
-
59
-
scFv16
Neuromedin-S
peptide
Agonist
neuromedin S-33, neuromedin U-23, neuromedin U-25, neuromedin S-36
peptide
Yes
No
You C, Zhang Y, Xu P, Huang S, Yin W, Eric Xu H, Jiang Y
10.1038/S41467-022-29683-W
2022-04-20
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
cryo-EM
7V68
-
3.4
R
Active
100
58
Gi/o
αi1
-
62
-
scFv16
iperoxo
LY2119620
small-molecule small-molecule
Agonist PAM
acetylcholine
small-molecule
Yes
No
-
-
2022-05-11
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7UL5
-
3.1
A
Inactive
3
77
-
-
-
-
-
Nanobody-6
Apo (no ligand)
none
Apo (no ligand)
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
-
-
2022-06-29
Yes
5HT5A
5-HT5A
5-Hydroxytryptamine
A
Human
cryo-EM
7UM6
-
2.8
A
Active
100
72
Gi/o
αo
Mini-Go
58
-
scFv16
lisuride
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Zhang S, Chen H, Zhang C, Yang Y, Popov P, Liu J, Krumm BE, Cao C, Kim K, Xiong Y, Katritch V, Shoichet BK, Jin J, Fay JF, Roth BL
10.1038/S41594-022-00796-6
2022-07-20
Yes
5HT5A
5-HT5A
5-Hydroxytryptamine
A
Human
cryo-EM
7UM7
-
2.8
A
Active
100
72
Gi/o
αo
Mini-Go
58
-
scFv16
methylergonovine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Zhang S, Chen H, Zhang C, Yang Y, Popov P, Liu J, Krumm BE, Cao C, Kim K, Xiong Y, Katritch V, Shoichet BK, Jin J, Fay JF, Roth BL
10.1038/S41594-022-00796-6
2022-07-20
Yes
5HT6R
5-HT6
5-Hydroxytryptamine
A
Human
cryo-EM
7XTB
7XTB_refined
3.3
R
Active
100
63
Gs
αs
-
60
BRIL
Nanobody-35
5-hydroxytryptamine
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Shen DD, Simon IA, Mao C, Tan Y, Zhang H, Harpsoe K, Li H, Zhang Y, You C, Yu X, Jiang Y, Zhang Y, Gloriam DE, Xu HE
10.1016/J.MOLCEL.2022.05.031
2022-07-27
Yes
5HT7R
5-HT7
5-Hydroxytryptamine
A
Human
cryo-EM
7XTC
7XTC_refined
3.2
R
Active
100
57
Gs
αs
-
61
BRIL
Nanobody-35
5-CT
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Huang S, Xu P, Shen DD, Simon IA, Mao C, Tan Y, Zhang H, Harpsoe K, Li H, Zhang Y, You C, Yu X, Jiang Y, Zhang Y, Gloriam DE, Xu HE
10.1016/J.MOLCEL.2022.05.031
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
X-ray
7SUS
7SUS_refined
2.7
A
Inactive
3
76
-
-
-
-
Rubredoxin
-
(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]-1-(5-methylpyrimidin-2-yl)-1-oxidanyl-propane-2-sulfonamide
small-molecule
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
cryo-EM
7W0L
7W0L_refined
3.6
R
Active
100
78
Gi/o
αi1
-
64
BRIL
scFv16
(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]-1-(5-methylpyrimidin-2-yl)-1-oxidanyl-propane-2-sulfonamide
small-molecule
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
cryo-EM
7W0M
7W0M_refined
3.7
R
Active
100
76
Gi/o
αi1
-
62
BRIL
scFv16
(1R,2S)-N-[4-(2,6-dimethoxyphenyl)-5-(6-methylpyridin-2-yl)-1,2,4-triazol-3-yl]-1-(5-methylpyrimidin-2-yl)-1-oxidanyl-propane-2-sulfonamide
small-molecule
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
cryo-EM
7W0N
-
4.2
R
Active
100
78
Gi/o
αi1
-
64
BRIL
scFv16
apelin receptor early endogenous ligand
peptide
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
cryo-EM
7W0O
7W0O_refined
3.8
R
Active
100
77
Gi/o
αi1
-
64
BRIL
scFv16
apelin receptor early endogenous ligand
peptide
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
APJ
apelin
Apelin
A
Human
cryo-EM
7W0P
7W0P_refined
3.2
R
Active
100
77
Gi/o
αi1
-
64
BRIL
scFv16
apelin receptor early endogenous ligand
peptide
Agonist
apelin-36, [Pyr1 ]apelin-13, Elabela/Toddler-11, apelin-13, Elabela/Toddler-21, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-32
peptide
Yes
No
Yue Y, Liu L, Wu LJ, Wu Y, Wang L, Li F, Liu J, Han GW, Chen B, Lin X, Brouillette RL, Breault E, Longpre JM, Shi S, Lei H, Sarret P, Stevens RC, Hanson MA, Xu F
10.1038/S41594-022-00797-5
2022-07-27
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7XOU
7XOU_refined
3.2
R
Active
100
67
Gs
αs
-
58
-
Nanobody-35
CCK-8
peptide
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
Ding Y, Zhang H, Liao YY, Chen LN, Ji SY, Qin J, Mao C, Shen DD, Lin L, Wang H, Zhang Y, Li XM
10.1038/S41421-022-00420-3
2022-07-20
Yes
CCKAR
CCK1
Cholecystokinin
A
Human
cryo-EM
7XOV
7XOV_refined
3.0
R
Active
100
67
Gs
αs
-
58
-
Nanobody-35
SR146131
small-molecule
Agonist
CCK-4, gastrin-17, desulfated cholecystokinin-8, CCK-33, CCK-58, CCK-39, CCK-8
peptide
Yes
No
Ding Y, Zhang H, Liao YY, Chen LN, Ji SY, Qin J, Mao C, Shen DD, Lin L, Wang H, Zhang Y, Li XM
10.1038/S41421-022-00420-3
2022-07-20
Yes
GASR
CCK2
Cholecystokinin
A
Human
cryo-EM
7XOW
7XOW_refined
3.1
R
Active
100
62
Gq/11
αq
-
61
-
scFv16
desulfated gastrin-17
peptide
Agonist
CCK-4, gastrin-17, gastrin-71, desulfated cholecystokinin-8, desulfated gastrin-34, desulfated gastrin-71, gastrin-14, desulfated gastrin-14, CCK-33, gastrin-34, CCK-58, CCK-39, CCK-8, desulfated gastrin-17
peptide
Yes
No
Ding Y, Zhang H, Liao YY, Chen LN, Ji SY, Qin J, Mao C, Shen DD, Lin L, Wang H, Zhang Y, Li XM
10.1038/S41421-022-00420-3
2022-07-20
Yes
GASR
CCK2
Cholecystokinin
A
Human
cryo-EM
7XOX
7XOX_refined
3.1
R
Active
100
62
Gq/11
αq
-
61
-
scFv16
CCK-8
peptide
Agonist
CCK-4, gastrin-17, gastrin-71, desulfated cholecystokinin-8, desulfated gastrin-34, desulfated gastrin-71, gastrin-14, desulfated gastrin-14, CCK-33, gastrin-34, CCK-58, CCK-39, CCK-8, desulfated gastrin-17
peptide
Yes
No
Ding Y, Zhang H, Liao YY, Chen LN, Ji SY, Qin J, Mao C, Shen DD, Lin L, Wang H, Zhang Y, Li XM
10.1038/S41421-022-00420-3
2022-07-20
Yes
GALR2
GAL2
Galanin
A
Human
cryo-EM
7XBD
-
3.1
A
Active
100
72
Gq/11
αq
-
64
-
scFv16
Galanin, Human
peptide
Agonist
galanin-like peptide, spexin-1, galanin
peptide
Yes
No
Heo Y, Ishimoto N, Jeon YE, Yun JH, Ohki M, Anraku Y, Sasaki M, Kita S, Fukuhara H, Ikuta T, Kawakami K, Inoue A, Maenaka K, Tame JRH, Lee W, Park SY
10.1371/JOURNAL.PBIO.3001714
2022-07-13
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7WJ5
7WJ5_refined
3.7
R
Active
100
76
Gi/o
αi1
-
60
BRIL
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Heo Y, Yoon E, Jeon YE, Yun JH, Ishimoto N, Woo H, Park SY, Song JJ, Lee W
10.7554/ELIFE.76823
2022-07-13
Yes
CX3C1
CX3 CR1
Chemokine
A
Human
cryo-EM
7XBW
7XBW_refined
2.8
R
Active
16
81
Gi/o
αi1
-
61
-
-
Apo (no ligand)
none
Apo (no ligand)
CX3 CL1
peptide
Yes
No
Lu M, Zhao W, Han S, Lin X, Xu T, Tan Q, Wang M, Yi C, Chu X, Yang W, Zhu Y, Wu B, Zhao Q
10.1126/SCIADV.ABN8048
2022-07-13
Yes
CX3C1
CX3 CR1
Chemokine
A
Human
cryo-EM
7XBX
7XBX_refined
3.4
R
Active
16
81
Gi/o
αi1
-
60
-
-
CX3CL1
peptide
Agonist
CX3 CL1
peptide
Yes
No
-
-
2022-07-13
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK3
7SK3_refined
3.8
A
Active
94
84
-
-
-
-
-
CID25 Fab light chain CID25 Fab heavy chain CID24 Fab light chain CID24 Fab heavy chain
CXCL12α
peptide
Agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK4
-
3.3
A
Active
94
84
-
-
-
-
-
CID25 Fab light chain CID25 Fab heavy chain CID24 Fab light chain CID24 Fab heavy chain
Stromal cell-derived factor 1
peptide
Agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK5
7SK5_refined
4.0
A
Active
94
83
-
-
-
-
-
CID24 Fab heavy chain CID24 Fab light chain anti-Fab Nanobody
Stromal cell-derived factor 1
peptide
Agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK6
7SK6_refined
4.0
A
Active
94
83
-
-
-
-
-
CID24 Fab light chain CID24 Fab heavy chain
Stromal cell-derived factor 1
peptide
Agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK7
-
3.3
A
Active
94
74
-
-
-
-
-
CID25 Fab light chain CID25 Fab heavy chain anti-Fab Nanobody
Stromal cell-derived factor 1
(1R)-4-[7-(3-carboxypropoxy)-6-methylquinolin-8-yl]-1-{[2-(4-hydroxypiperidin-1-yl)-1,3-thiazol-4-yl]methyl}-1,4-diazepan-1-ium
peptide small-molecule
Agonist Partial agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
GPBAR
GPBA
Bile acid
A
Human
cryo-EM
7XTQ
7XTQ_refined
3.2
R
Active
100
83
Gs
αs
-
58
-
Nanobody-35
CHEMBL2181246
small-molecule
Agonist
lithocholic acid, chenodeoxycholic acid, cholic acid, deoxycholic acid
small-molecule
No
No
Ma L, Yang F, Wu X, Mao C, Guo L, Miao T, Zang SK, Jiang X, Shen DD, Wei T, Zhou H, Wei Q, Li S, Shu Q, Feng S, Jiang C, Chu B, Du L, Sun JP, Yu X, Zhang Y, Zhang P
10.1073/PNAS.2117054119
2022-07-06
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK9
7SK9_refined
3.7
A
Active
94
78
-
-
-
-
-
CID24 Fab heavy chain CID24 Fab light chain
(1R)-4-[7-(3-carboxypropoxy)-6-methylquinolin-8-yl]-1-{[2-(4-hydroxypiperidin-1-yl)-1,3-thiazol-4-yl]methyl}-1,4-diazepan-1-ium
small-molecule
Partial agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
ACKR3
ACKR3
Chemokine
A
Human
cryo-EM
7SK8
7SK8_refined
3.3
A
Active
94
85
-
-
-
-
-
CID25 Fab light chain CID25 Fab heavy chain CID24 Fab light chain CID24 Fab heavy chain
Stromal cell-derived factor 1
(1R)-4-[7-(3-carboxypropoxy)-6-methylquinolin-8-yl]-1-{[2-(4-hydroxypiperidin-1-yl)-1,3-thiazol-4-yl]methyl}-1,4-diazepan-1-ium
peptide small-molecule
Agonist Partial agonist
CXCL12α, CXCL11
peptide
Yes
No
Yen YC, Schafer CT, Gustavsson M, Eberle SA, Dominik PK, Deneka D, Zhang P, Schall TJ, Kossiakoff AA, Tesmer JJG, Handel TM
10.1126/SCIADV.ABN8063
2022-07-27
Yes
MRGRD
MRGPRD
A orphans
A
Human
cryo-EM
7Y12
7Y12_refined
3.1
R
Active
100
82
Gi/o
αi1
-
62
BRIL
scFv16
β-alanine
small-molecule
Agonist
β-alanine
small-molecule
No
No
-
-
2022-07-20
Yes
MRGRD
MRGPRD
A orphans
A
Human
cryo-EM
7Y13
-
3.1
R
Active
58
82
-
-
-
-
BRIL
-
Apo (no ligand)
none
Apo (no ligand)
β-alanine
small-molecule
No
No
-
-
2022-07-20
Yes
MRGRD
MRGPRD
A orphans
A
Human
cryo-EM
7Y14
7Y14_refined
3.2
R
Active
58
82
-
-
-
-
BRIL
-
β-alanine
small-molecule
Agonist
β-alanine
small-molecule
No
No
-
-
2022-07-20
Yes
MRGRD
MRGPRD
A orphans
A
Human
cryo-EM
7Y15
7Y15_refined
2.9
R
Active
100
82
Gi/o
αi1
-
62
BRIL
scFv16
Apo (no ligand)
none
Apo (no ligand)
β-alanine
small-molecule
No
No
-
-
2022-07-20
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
8DCR
-
2.6
R
Active
100
57
Gs
αs
-
51
T4-Lysozyme
Nanobody-35
Dobutamine
small-molecule
Agonist
-
-
Yes
No
Su M, Paknejad N, Zhu L, Wang J, Do HN, Miao Y, Liu W, Hite RK, Huang XY
10.1038/S41467-022-31823-1
2022-07-27
Yes
ADRB1
β1
Adrenoceptors
A
Wild turkey
cryo-EM
8DCS
8DCS_refined
2.5
R
Active
100
57
Gs
αs
-
51
T4-Lysozyme
Nanobody-35
4-{[(2S)-3-(tert-butylamino)-2-hydroxypropyl]oxy}-3H-indole-2-carbonitrile
small-molecule
Agonist
-
-
Yes
No
Su M, Paknejad N, Zhu L, Wang J, Do HN, Miao Y, Liu W, Hite RK, Huang XY
10.1038/S41467-022-31823-1
2022-07-27
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
cryo-EM
8DPF
-
2.8
A
Active
100
58
Gq/11
αq
Gi2-mini-Gq chimera
62
-
scFv16
lorcaserin
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Gumpper RH, Fay JF, Roth BL
10.1016/J.CELREP.2022.111211
2022-08-24
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
cryo-EM
8DPG
-
3.6
A
Active
100
58
Gq/11
αq
Gi2-mini-Gq chimera
62
-
scFv16
psilocin
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Gumpper RH, Fay JF, Roth BL
10.1016/J.CELREP.2022.111211
2022-08-24
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
cryo-EM
8DPH
-
3.2
A
Active
100
58
Gq/11
αq
Gi2-mini-Gq chimera
62
-
scFv16
lorcaserin
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Gumpper RH, Fay JF, Roth BL
10.1016/J.CELREP.2022.111211
2022-08-24
Yes
5HT2C
5-HT2C
5-Hydroxytryptamine
A
Human
cryo-EM
8DPI
-
3.4
A
Active
100
58
Gq/11
αq
Gi2-mini-Gq chimera
62
-
scFv16
lorcaserin
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Gumpper RH, Fay JF, Roth BL
10.1016/J.CELREP.2022.111211
2022-08-24
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7XAT
7XAT_refined
2.9
A
Active
100
78
Gi/o
αi1
-
63
-
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Bo Q, Yang F, Li Y, Meng X, Zhang H, Zhou Y, Ling S, Sun D, Lv P, Liu L, Shi P, Tian C
10.1038/S41421-022-00405-2
2022-08-31
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7XAU
7XAU_refined
3.0
A
Active
100
76
Gi/o
αi1
-
63
-
scFv16
Octreotide
peptide
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Bo Q, Yang F, Li Y, Meng X, Zhang H, Zhou Y, Ling S, Sun D, Lv P, Liu L, Shi P, Tian C
10.1038/S41421-022-00405-2
2022-08-31
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7XAV
7XAV_refined
2.9
A
Active
100
76
Gi/o
αi1
-
63
-
scFv16
lanreotide
peptide
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Bo Q, Yang F, Li Y, Meng X, Zhang H, Zhou Y, Ling S, Sun D, Lv P, Liu L, Shi P, Tian C
10.1038/S41421-022-00405-2
2022-08-31
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7XMR
7XMR_refined
3.1
R
Active
100
77
Gi/o
αi1
-
63
-
-
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Zhao W, Han S, Qiu N, Feng W, Lu M, Zhang W, Wang M, Zhou Q, Chen S, Xu W, Du J, Chu X, Yi C, Dai A, Hu L, Shen MY, Sun Y, Zhang Q, Ma Y, Zhong W, Yang D, Wang MW, Wu B, Zhao Q
10.1038/S41422-022-00679-X
2022-08-03
Yes
SSR2
SST2
Somatostatin
A
Human
X-ray
7XN9
7XN9_refined
2.6
A
Inactive
3
79
-
-
-
-
-
-
L-054,522
small-molecule
Antagonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Zhao W, Han S, Qiu N, Feng W, Lu M, Zhang W, Wang M, Zhou Q, Chen S, Xu W, Du J, Chu X, Yi C, Dai A, Hu L, Shen MY, Sun Y, Zhang Q, Ma Y, Zhong W, Yang D, Wang MW, Wu B, Zhao Q
10.1038/S41422-022-00679-X
2022-08-03
Yes
SSR2
SST2
Somatostatin
A
Human
X-ray
7XNA
-
2.7
A
Inactive
3
78
-
-
-
-
-
-
CYN 154806
peptide
Antagonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
No
No
Zhao W, Han S, Qiu N, Feng W, Lu M, Zhang W, Wang M, Zhou Q, Chen S, Xu W, Du J, Chu X, Yi C, Dai A, Hu L, Shen MY, Sun Y, Zhang Q, Ma Y, Zhong W, Yang D, Wang MW, Wu B, Zhao Q
10.1038/S41422-022-00679-X
2022-08-03
Yes
SSR4
SST4
Somatostatin
A
Human
cryo-EM
7XMS
7XMS_refined
2.9
R
Active
100
71
Gi/o
αi1
-
63
-
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Zhao W, Han S, Qiu N, Feng W, Lu M, Zhang W, Wang M, Zhou Q, Chen S, Xu W, Du J, Chu X, Yi C, Dai A, Hu L, Shen MY, Sun Y, Zhang Q, Ma Y, Zhong W, Yang D, Wang MW, Wu B, Zhao Q
10.1038/S41422-022-00679-X
2022-08-03
Yes
SSR4
SST4
Somatostatin
A
Human
cryo-EM
7XMT
7XMT_refined
2.8
R
Active
100
68
Gi/o
αi1
-
63
-
scFv16
J-2156
small-molecule
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Zhao W, Han S, Qiu N, Feng W, Lu M, Zhang W, Wang M, Zhou Q, Chen S, Xu W, Du J, Chu X, Yi C, Dai A, Hu L, Shen MY, Sun Y, Zhang Q, Ma Y, Zhong W, Yang D, Wang MW, Wu B, Zhao Q
10.1038/S41422-022-00679-X
2022-08-03
Yes
TRFR
TRH1
Thyrotropin-releasing hormone
A
Human
cryo-EM
7X1T
-
3.3
A
Active
100
68
Gq/11
αq
-
61
-
scFv16
taltirelin
small-molecule
Agonist
TRH
peptide
Yes
No
Yang F, Zhang H, Meng X, Li Y, Zhou Y, Ling S, Sun D, Lv P, Liu L, Shi P, Tian C
10.1038/S41422-022-00646-6
2022-08-31
Yes
TRFR
TRH1
Thyrotropin-releasing hormone
A
Human
cryo-EM
7X1U
-
3.2
A
Active
100
68
Gq/11
αq
-
62
-
scFv16
TRH
peptide
Agonist
TRH
peptide
Yes
No
Yang F, Zhang H, Meng X, Li Y, Zhou Y, Ling S, Sun D, Lv P, Liu L, Shi P, Tian C
10.1038/S41422-022-00646-6
2022-08-31
Yes
OXYR
OT
Vasopressin and oxytocin
A
Human
cryo-EM
7QVM
7QVM_refined
3.3
R
Active
100
64
Gi/o
αo
-
59
-
scFv16
oxytocin
peptide
Agonist
oxytocin, vasopressin
peptide
Yes
No
Waltenspuhl Y, Ehrenmann J, Vacca S, Thom C, Medalia O, Pluckthun A
10.1038/S41467-022-31325-0
2022-08-10
Yes
CCR2
CCR2
Chemokine
A
Human
cryo-EM
7XA3
7XA3_refined
2.9
R
Active
100
79
Gi/o
αi1
-
65
-
scFv16
C-C motif chemokine 2
peptide
Agonist
CCL24, CCL2, CCL26, CCL8, CCL13, CCL7, CCL16, CCL11
peptide
No
No
Shao Z, Tan Y, Shen Q, Hou L, Yao B, Qin J, Xu P, Mao C, Chen LN, Zhang H, Shen DD, Zhang C, Li W, Du X, Li F, Chen ZH, Jiang Y, Xu HE, Ying S, Ma H, Zhang Y, Shen H
10.1038/S41421-022-00403-4
2022-08-24
Yes
CCR3
CCR3
Chemokine
A
Human
cryo-EM
7X9Y
7X9Y_refined
3.1
R
Active
100
83
Gi/o
αi1
-
62
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
CCL24, CCL5, CCL2, CCL28, CXCL9, CCL26, CCL13, CCL8, CCL7, CCL15, CXCL10, CXCL11, CCL11
peptide
No
No
Shao Z, Tan Y, Shen Q, Hou L, Yao B, Qin J, Xu P, Mao C, Chen LN, Zhang H, Shen DD, Zhang C, Li W, Du X, Li F, Chen ZH, Jiang Y, Xu HE, Ying S, Ma H, Zhang Y, Shen H
10.1038/S41421-022-00403-4
2022-08-24
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7XW5
-
3.0
R
Active
100
75
Gs
αs
-
59
-
Nanobody-35
Glycoprotein hormones alpha chain
Thyrotropin subunit beta
N-[4-[[5-[(2S)-3-benzyl-5-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxyphenyl]methoxy]phenyl]acetamide
protein protein small-molecule
Agonist
TSH
peptide
Yes
No
Duan J, Xu P, Luan X, Ji Y, He X, Song N, Yuan Q, Jin Y, Cheng X, Jiang H, Zheng J, Zhang S, Jiang Y, Xu HE
10.1038/S41586-022-05173-3
2022-08-24
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7XW6
-
2.8
R
Active
100
74
Gs
αs
-
57
-
Nanobody-35
M22 antibody light chain
M22 antibody heavy chain
N-[4-[[5-[(2S)-3-benzyl-5-hydroxy-4-oxo-1,2-dihydroquinazolin-2-yl]-2-methoxyphenyl]methoxy]phenyl]acetamide
protein protein small-molecule
Agonist
TSH
peptide
Yes
No
Duan J, Xu P, Luan X, Ji Y, He X, Song N, Yuan Q, Jin Y, Cheng X, Jiang H, Zheng J, Zhang S, Jiang Y, Xu HE
10.1038/S41586-022-05173-3
2022-08-17
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7XW7
-
5.5
R
Inactive
14
74
-
-
-
-
-
-
K1-70 scFv heavy chain
K1-70 scFv light chain
protein protein
Antagonist
TSH
peptide
Yes
No
Duan J, Xu P, Luan X, Ji Y, He X, Song N, Yuan Q, Jin Y, Cheng X, Jiang H, Zheng J, Zhang S, Jiang Y, Xu HE
10.1038/S41586-022-05173-3
2022-08-17
Yes
S1PR5
S1P5
Lysophospholipid (S1P)
A
Human
X-ray
7YXA
7YXA_refined
2.2
A
Inactive
9
72
-
-
-
-
BRIL
-
4-[6-(2-naphthalen-1-ylethoxy)-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl]butanoic acid
small-molecule
Antagonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
-
-
2022-08-10
Yes
PE2R3
EP3
Prostanoid
A
Human
cryo-EM
7WU9
7WU9_refined
3.4
R
Active
100
70
Gi/o
αi1
-
38
-
scFv16
-
-
-
PGD2 , PGE1 , thromboxane A2 , PGE2 , PGF2α , PGI2
small-molecule
Yes
No
-
-
2022-08-17
Yes
AA2AR
A2A
Adenosine
A
Human
cryo-EM
7T32
7T32_refined
3.4
A
Inactive
1
69
-
-
-
-
BRIL
-
ZM-241385
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Zhang K, Wu H, Hoppe N, Manglik A, Cheng Y
10.1038/S41467-022-32125-2
2022-08-10
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
8CU6
8CU6_refined
2.8
A
Inactive
1
72
-
-
-
-
BRIL
-
LJ-4517
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Shiriaeva A, Park D, Kim G, Lee Y, Hou X, Jarhad DB, Kim G, Yu J, Hyun YE, Kim W, Gao ZG, Jacobson KA, Han GW, Stevens RC, Jeong LS, Choi S, Cherezov V
10.1021/ACS.JMEDCHEM.2C00462
2022-08-31
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
8CU7
-
2.1
A
Inactive
1
72
-
-
-
-
BRIL
-
LJ-4517
small-molecule
Antagonist
adenosine
small-molecule
Yes
Yes
-
-
2022-08-31
Yes
AA2AR
A2A
Adenosine
A
Human
X-ray
8DU3
8DU3_refined
2.5
A
Inactive
1
72
-
-
-
-
BRIL
-
(4M)-6-bromo-4-(furan-2-yl)quinazolin-2-amine
small-molecule
Antagonist
adenosine
small-molecule
Yes
No
Bolteau R, Duroux R, Laversin A, Vreulz B, Shiriaeva A, Stauch B, Han GW, Cherezov V, Renault N, Barczyk A, Ravez S, Coevoet M, Melnyk P, Liberelle M, Yous S
10.1016/J.EJMECH.2022.114620
2022-08-10
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVJ
-
3.2
R
Active
100
62
Gs
αs
-
59
-
Nanobody-35
PTHrP[1-36]
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVK
7VVK_refined
3.3
R
Active
100
56
Gs
αs
-
58
-
Nanobody-35
teriparatide
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVL
-
2.8
R
Active
100
58
Gs
αs
-
58
-
Nanobody-35
teriparatide
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVM
-
3.2
R
Active
100
60
Gs
αs
-
58
-
Nanobody-35
Parathyroid hormone
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVN
-
3.8
R
Active
100
51
Gs
αs
-
58
-
Nanobody-35
teriparatide
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
7VVO
-
4.1
R
Active
100
51
Gs
αs
-
58
-
Nanobody-35
Parathyroid hormone
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
-
-
2022-08-03
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7XKD
-
2.4
R
Active
100
26
Gs
αs
-
57
-
Nanobody-35
PRASTERONE
small-molecule
Agonist
-
-
No
No
-
-
2022-08-10
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7XKE
7XKE_refined
2.9
R
Active
100
25
Gs
αs
Mini-Gs
60
-
Nanobody-35
PRASTERONE
small-molecule
Agonist
-
-
No
No
-
-
2022-08-10
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7XKF
-
2.4
R
Active
100
26
Gs
αs
-
57
-
Nanobody-35
PRASTERONE
small-molecule
Agonist
-
-
No
No
-
-
2022-08-10
Yes
AGRG2
ADGRG2
ADGRG
B2
Mouse
cryo-EM
7YP7
7YP7_refined
3.1
R
Active
100
24
Gs
αs
-
59
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
-
-
2022-08-24
Yes
SMO
SMO
Frizzled
F
Mouse
cryo-EM
8CXO
8CXO_refined
3.7
A
Inactive
15
43
-
-
-
-
GlgA glycogen synthase
-
Cholesterol
small-molecule
Agonist
-
-
No
No
Zhang K, Wu H, Hoppe N, Manglik A, Cheng Y
10.1038/S41467-022-32125-2
2022-08-03
Yes
GP119
GPR119
GPR18, GPR55 and GPR119
A
Human
cryo-EM
7XZ5
-
3.1
R
Active
100
87
Gs
αs
-
58
BRIL
Nanobody-35
(4R,7R,18E)-4,7-dihydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacos-18-en-1-aminium 4-oxide
small-molecule
Agonist
anandamide, N-oleoylethanolamide, SEA, N-palmitoylethanolamine
small-molecule
Yes
No
Xu P, Huang S, Guo S, Yun Y, Cheng X, He X, Cai P, Lan Y, Zhou H, Jiang H, Jiang Y, Xie X, Xu HE
10.1038/S41594-022-00816-5
2022-08-24
Yes
GP119
GPR119
GPR18, GPR55 and GPR119
A
Human
cryo-EM
7XZ6
-
2.8
R
Active
100
87
Gs
αs
-
58
BRIL
Nanobody-35
APD668
small-molecule
Agonist
anandamide, N-oleoylethanolamide, SEA, N-palmitoylethanolamine
small-molecule
Yes
No
Xu P, Huang S, Guo S, Yun Y, Cheng X, He X, Cai P, Lan Y, Zhou H, Jiang H, Jiang Y, Xie X, Xu HE
10.1038/S41594-022-00816-5
2022-08-24
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7T9I
-
2.9
R
Active
100
78
Gs
αs
Mini-Gs
56
-
Nanobody-35
Glycoprotein hormones alpha chain
Thyrotropin subunit beta
protein protein
Agonist
TSH
peptide
Yes
No
Faust B, Billesbolle CB, Suomivuori CM, Singh I, Zhang K, Hoppe N, Pinto AFM, Diedrich JK, Muftuoglu Y, Szkudlinski MW, Saghatelian A, Dror RO, Cheng Y, Manglik A
10.1038/S41586-022-05159-1
2022-08-03
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7T9M
-
3.1
R
Inactive
31
74
-
-
-
-
-
-
CS-17 heavy chain
CS-17 light chain
protein protein
Inverse agonist
TSH
peptide
Yes
No
Faust B, Billesbolle CB, Suomivuori CM, Singh I, Zhang K, Hoppe N, Pinto AFM, Diedrich JK, Muftuoglu Y, Szkudlinski MW, Saghatelian A, Dror RO, Cheng Y, Manglik A
10.1038/S41586-022-05159-1
2022-08-10
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7T9N
-
2.9
R
Active
100
73
Gs
αs
Mini-Gs
56
-
M22 Fab light chain M22 Fab heavy chain Nanobody-35
M22 antibody light chain
M22 antibody heavy chain
protein protein
Agonist
TSH
peptide
Yes
No
Faust B, Billesbolle CB, Suomivuori CM, Singh I, Zhang K, Hoppe N, Pinto AFM, Diedrich JK, Muftuoglu Y, Szkudlinski MW, Saghatelian A, Dror RO, Cheng Y, Manglik A
10.1038/S41586-022-05159-1
2022-08-03
Yes
TSHR
TSH
Glycoprotein hormone
A
Human
cryo-EM
7UTZ
-
2.4
R
Active
100
79
Gs
αs
Mini-Gs
56
-
Nanobody-35
Glycoprotein hormones alpha chain analog TR1402
Thyrotropin subunit beta
protein protein
Agonist
TSH
peptide
Yes
No
Faust B, Billesbolle CB, Suomivuori CM, Singh I, Zhang K, Hoppe N, Pinto AFM, Diedrich JK, Muftuoglu Y, Szkudlinski MW, Saghatelian A, Dror RO, Cheng Y, Manglik A
10.1038/S41586-022-05159-1
2022-08-03
Yes
HRH3
H3
Histamine
A
Human
X-ray
7F61
7F61_refined
2.6
A
Inactive
8
68
-
-
-
-
BRIL
-
N-ethyl-3-fluoro-3-[3-fluoro-4-(pyrrolidin-1-ylmethyl)phenyl]cyclobutane-1-carboxamide
small-molecule
Antagonist
histamine
small-molecule
No
No
Peng X, Yang L, Liu Z, Lou S, Mei S, Li M, Chen Z, Zhang H
10.1038/S41467-022-33880-Y
2022-10-26
Yes
P2Y12
P2Y12
P2Y
A
Human
Unknown
7PP1
-
2.8
A
Intermediate
42
78
-
-
-
-
BRIL
-
selatogrel
small-molecule
Antagonist
ATP, ADP
small-molecule
Yes
No
Pons V, Garcia C, Tidten-Luksch N, Mac Sweeney A, Caroff E, Gales C, Riederer MA
10.1016/j.bcp.2022.115291
2022-11-02
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
cryo-EM
7SRQ
7SRQ_refined
2.7
R
Intermediate
42
53
-
-
-
-
-
-
Lysergide
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Cao C, Barros-Alvarez X, Zhang S, Kim K, Damgen MA, Panova O, Suomivuori CM, Fay JF, Zhong X, Krumm BE, Gumpper RH, Seven AB, Robertson MJ, Krogan NJ, Huttenhain R, Nichols DE, Dror RO, Skiniotis G, Roth BL
10.1016/J.NEURON.2022.08.006
2022-09-21
Yes
V2R
V2
Vasopressin and oxytocin
A
Human
cryo-EM
7R0C
-
4.7
A
Active
100
76
Beta
Beta-arrestin-1
-
84
-
scFv30
-
-
-
oxytocin, vasopressin
peptide
Yes
No
Bous J, Fouillen A, Orcel H, Trapani S, Cong X, Fontanel S, Saint-Paul J, Lai-Kee-Him J, Urbach S, Sibille N, Sounier R, Granier S, Mouillac B, Bron P
10.1126/SCIADV.ABO7761
2022-09-14
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
cryo-EM
7SRR
-
2.9
R
Active
100
57
Gq/11
αq
Gi2-mini-Gq chimera
63
-
scFv16
Lysergide
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Cao C, Barros-Alvarez X, Zhang S, Kim K, Damgen MA, Panova O, Suomivuori CM, Fay JF, Zhong X, Krumm BE, Gumpper RH, Seven AB, Robertson MJ, Krogan NJ, Huttenhain R, Nichols DE, Dror RO, Skiniotis G, Roth BL
10.1016/J.NEURON.2022.08.006
2022-09-21
Yes
5HT2B
5-HT2B
5-Hydroxytryptamine
A
Human
cryo-EM
7SRS
-
3.3
R
Active
100
60
Beta
Beta-arrestin-1
-
85
-
Fab light chain Fab heavy chain Fab30 heavy chain Fab30 light chain
Lysergide
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Cao C, Barros-Alvarez X, Zhang S, Kim K, Damgen MA, Panova O, Suomivuori CM, Fay JF, Zhong X, Krumm BE, Gumpper RH, Seven AB, Robertson MJ, Krogan NJ, Huttenhain R, Nichols DE, Dror RO, Skiniotis G, Roth BL
10.1016/J.NEURON.2022.08.006
2022-09-21
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7T2G
-
2.5
R
Active
100
70
Gi/o
αi1
-
62
BRIL
-
CHEMBL58362
small-molecule
Agonist
-
-
Yes
No
Qu Q, Huang W, Aydin D, Paggi JM, Seven AB, Wang H, Chakraborty S, Che T, DiBerto JF, Robertson MJ, Inoue A, Suomivuori CM, Roth BL, Majumdar S, Dror RO, Kobilka BK, Skiniotis G
10.1038/S41589-022-01208-Y
2022-12-07
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7T2H
-
3.2
D
Active
100
71
Gi/o
αi1
-
61
-
scFv16
LOFENTANIL
small-molecule
Agonist
-
-
Yes
No
Qu Q, Huang W, Aydin D, Paggi JM, Seven AB, Wang H, Chakraborty S, Che T, DiBerto JF, Robertson MJ, Inoue A, Suomivuori CM, Roth BL, Majumdar S, Dror RO, Kobilka BK, Skiniotis G
10.1038/S41589-022-01208-Y
2022-12-07
Yes
CRFR2
CRF2
Corticotropin-releasing factor
B1
Human
cryo-EM
7TRY
-
3.7
P
Active
100
79
Gq/11
α11
-
60
-
-
Urocortin
peptide
Agonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2, urocortin 3
peptide
No
No
Zhao LH, Lin J, Ji SY, Zhou XE, Mao C, Shen DD, He X, Xiao P, Sun J, Melcher K, Zhang Y, Yu X, Xu HE
10.1038/S41467-022-33851-3
2022-11-09
Yes
CRFR2
CRF2
Corticotropin-releasing factor
B1
Human
cryo-EM
7TS0
7TS0_refined
2.8
P
Active
100
72
Gi/o
αo
-
63
-
scFv16
Urocortin
peptide
Agonist
corticotrophin-releasing hormone, urocortin 1, urocortin 2, urocortin 3
peptide
No
No
Zhao LH, Lin J, Ji SY, Zhou XE, Mao C, Shen DD, He X, Xiao P, Sun J, Melcher K, Zhang Y, Yu X, Xu HE
10.1038/S41467-022-33851-3
2022-11-09
Yes
OPRM
μ
Opioid
A
Mouse
cryo-EM
7U2K
7U2K_refined
3.3
D
Active
100
71
Gi/o
αi1
-
61
-
-
CHEMBL147044
small-molecule
Agonist
-
-
Yes
No
Faouzi A, Wang H, Zaidi SA, DiBerto JF, Che T, Qu Q, Robertson MJ, Madasu MK, El Daibani A, Varga BR, Zhang T, Ruiz C, Liu S, Xu J, Appourchaux K, Slocum ST, Eans SO, Cameron MD, Al-Hasani R, Pan YX, Roth BL, McLaughlin JP, Skiniotis G, Katritch V, Kobilka BK, Majumdar S
10.1038/S41586-022-05588-Y
2022-12-07
Yes
FPR1
FPR1
Formylpeptide
A
Human
cryo-EM
7VFX
7VFX_refined
2.8
R
Active
100
84
Gi/o
αi1
-
62
-
scFv16
Peptide agonist fMet-Ile-Phe-Leu
peptide
Agonist
fMet-Leu-Phe, annexin I, spinorphin, cathepsin G
peptide
Yes
No
Chen G, Wang X, Liao Q, Ge Y, Jiao H, Chen Q, Liu Y, Lyu W, Zhu L, van Zundert GCP, Robertson MJ, Skiniotis G, Du Y, Hu H, Ye RD
10.1038/S41467-022-32822-Y
2022-09-21
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7VIE
7VIE_refined
2.9
F
Active
100
73
Gi/o
αi1
-
64
-
scFv16
sphingosine 1-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yu L, He L, Gan B, Ti R, Xiao Q, Hu H, Zhu L, Wang S, Ren R
10.1073/PNAS.2117716119
2022-09-28
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7VIF
-
2.8
F
Active
100
73
Gi/o
αi1
-
64
-
scFv16
(S)-FTY720-phosphate
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yu L, He L, Gan B, Ti R, Xiao Q, Hu H, Zhu L, Wang S, Ren R
10.1073/PNAS.2117716119
2022-09-28
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7VIG
-
2.9
F
Active
100
73
Gi/o
αi1
-
63
-
scFv16
icanbelimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yu L, He L, Gan B, Ti R, Xiao Q, Hu H, Zhu L, Wang S, Ren R
10.1073/PNAS.2117716119
2022-09-28
Yes
S1PR1
S1P1
Lysophospholipid (S1P)
A
Human
cryo-EM
7VIH
-
3.0
F
Active
100
73
Gi/o
αi1
-
64
-
scFv16
icanbelimod
small-molecule
Agonist
sphingosylphosphorylcholine, sphingosine 1-phosphate
small-molecule
Yes
No
Yu L, He L, Gan B, Ti R, Xiao Q, Hu H, Zhu L, Wang S, Ren R
10.1073/PNAS.2117716119
2022-09-28
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7W6P
7W6P_refined
3.5
R
Active
100
55
Gi/o
αo
-
58
-
scFv16
N-pyridin-4-ylisoquinolin-4-amine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Fink EA, Xu J, Hubner H, Braz JM, Seemann P, Avet C, Craik V, Weikert D, Schmidt MF, Webb CM, Tolmachova NA, Moroz YS, Huang XP, Kalyanaraman C, Gahbauer S, Chen G, Liu Z, Jacobson MP, Irwin JJ, Bouvier M, Du Y, Shoichet BK, Basbaum AI, Gmeiner P
10.1126/SCIENCE.ABN7065
2022-09-28
Yes
ADA2A
α2A
Adrenoceptors
A
Human
cryo-EM
7W7E
7W7E_refined
3.4
R
Active
100
56
Gi/o
αo
-
59
-
scFv16
5-(3-Bicyclo[4.2.0]octa-1,3,5-trienyl)-1,2,3,6-tetrahydropyridine
small-molecule
Agonist
(-)-adrenaline, (-)-noradrenaline
small-molecule
Yes
No
Fink EA, Xu J, Hubner H, Braz JM, Seemann P, Avet C, Craik V, Weikert D, Schmidt MF, Webb CM, Tolmachova NA, Moroz YS, Huang XP, Kalyanaraman C, Gahbauer S, Chen G, Liu Z, Jacobson MP, Irwin JJ, Bouvier M, Du Y, Shoichet BK, Basbaum AI, Gmeiner P
10.1126/SCIENCE.ABN7065
2022-09-28
Yes
GP119
GPR119
GPR18, GPR55 and GPR119
A
Human
cryo-EM
7WCM
7WCM_refined
2.3
R
Active
100
86
Gs
αs
-
60
-
Nanobody-35
MBX-2982
small-molecule
Agonist
anandamide, N-oleoylethanolamide, SEA, N-palmitoylethanolamine
small-molecule
Yes
No
Qian Y, Wang J, Yang L, Liu Y, Wang L, Liu W, Lin Y, Yang H, Ma L, Ye S, Wu S, Qiao A
10.1038/S41467-022-34696-6
2022-12-21
Yes
GP119
GPR119
GPR18, GPR55 and GPR119
A
Human
cryo-EM
7WCN
7WCN_refined
2.9
R
Active
100
86
Gs
αs
-
60
-
Nanobody-35
AR231453
small-molecule
Agonist
anandamide, N-oleoylethanolamide, SEA, N-palmitoylethanolamine
small-molecule
Yes
No
Qian Y, Wang J, Yang L, Liu Y, Wang L, Liu W, Lin Y, Yang H, Ma L, Ye S, Wu S, Qiao A
10.1038/S41467-022-34696-6
2022-12-21
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WXU
-
2.9
R
Active
100
30
Gq/11
αq
-
60
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhu X, Qian Y, Li X, Xu Z, Xia R, Wang N, Liang J, Yin H, Zhang A, Guo C, Wang G, He Y
10.1038/S41467-022-33173-4
2022-09-28
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WXW
-
2.8
R
Active
100
30
Gs
αs
Mini-Gs
56
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhu X, Qian Y, Li X, Xu Z, Xia R, Wang N, Liang J, Yin H, Zhang A, Guo C, Wang G, He Y
10.1038/S41467-022-33173-4
2022-09-28
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WY0
-
2.8
R
Active
100
30
G12/13
α13
-
55
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhu X, Qian Y, Li X, Xu Z, Xia R, Wang N, Liang J, Yin H, Zhang A, Guo C, Wang G, He Y
10.1038/S41467-022-33173-4
2022-09-28
Yes
AGRL3
ADGRL3
ADGRL
B2
Mouse
cryo-EM
7WY5
-
2.8
R
Active
100
17
Gq/11
αq
Mini-Gq
59
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qian Y, Ma Z, Liu C, Li X, Zhu X, Wang N, Xu Z, Xia R, Liang J, Duan Y, Yin H, Xiong Y, Zhang A, Guo C, Chen Z, Huang Z, He Y
10.1016/J.MOLCEL.2022.10.009
2022-10-26
Yes
AGRL3
ADGRL3
ADGRL
B2
Mouse
cryo-EM
7WY8
-
2.8
R
Active
100
17
Gs
αs
Mini-Gs
55
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qian Y, Ma Z, Liu C, Li X, Zhu X, Wang N, Xu Z, Xia R, Liang J, Duan Y, Yin H, Xiong Y, Zhang A, Guo C, Chen Z, Huang Z, He Y
10.1016/J.MOLCEL.2022.10.009
2022-10-26
Yes
AGRL3
ADGRL3
ADGRL
B2
Mouse
cryo-EM
7WYB
7WYB_refined
3.0
R
Active
100
17
Gi/o
αi1
-
64
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qian Y, Ma Z, Liu C, Li X, Zhu X, Wang N, Xu Z, Xia R, Liang J, Duan Y, Yin H, Xiong Y, Zhang A, Guo C, Chen Z, Huang Z, He Y
10.1016/J.MOLCEL.2022.10.009
2022-10-26
Yes
GPR88
GPR88
A orphans
A
Human
cryo-EM
7WZ4
7WZ4_refined
3.0
R
Active
100
61
Gi/o
αi1
-
61
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
Yes
No
Chen G, Xu J, Inoue A, Schmidt MF, Bai C, Lu Q, Gmeiner P, Liu Z, Du Y
10.1038/S41467-022-30081-5
2022-10-26
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7WZ7
-
2.8
R
Active
100
30
G12/13
α12
Mini-G12
52
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhu X, Qian Y, Li X, Xu Z, Xia R, Wang N, Liang J, Yin H, Zhang A, Guo C, Wang G, He Y
10.1038/S41467-022-33173-4
2022-09-28
Yes
AGRL3
ADGRL3
ADGRL
B2
Mouse
cryo-EM
7X10
-
2.9
R
Active
100
17
G12/13
α12
-
52
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Qian Y, Ma Z, Liu C, Li X, Zhu X, Wang N, Xu Z, Xia R, Liang J, Duan Y, Yin H, Xiong Y, Zhang A, Guo C, Chen Z, Huang Z, He Y
10.1016/J.MOLCEL.2022.10.009
2022-11-09
Yes
AGRF1
ADGRF1
ADGRF
B2
Human
cryo-EM
7X2V
7X2V_refined
3.1
R
Active
100
30
Gi/o
αi1
-
62
-
scFv16
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Zhu X, Qian Y, Li X, Xu Z, Xia R, Wang N, Liang J, Yin H, Zhang A, Guo C, Wang G, He Y
10.1038/S41467-022-33173-4
2022-09-28
Yes
T2R46
TAS2R46
Taste 2
T
Human
cryo-EM
7XP4
-
3.0
R
Active
-
97
Gi/o
αt3
-
42
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Xu W, Wu L, Liu S, Liu X, Cao X, Zhou C, Zhang J, Fu Y, Guo Y, Wu Y, Tan Q, Wang L, Liu J, Jiang L, Fan Z, Pei Y, Yu J, Cheng J, Zhao S, Hao X, Liu ZJ, Hua T
10.1126/SCIENCE.ABO1633
2022-10-12
Yes
5HT5A
5-HT5A
5-Hydroxytryptamine
A
Human
cryo-EM
7X5H
7X5H_refined
3.1
R
Active
100
77
Gi/o
αi1
-
63
BRIL
scFv16
5-CT
small-molecule
Agonist
5-hydroxytryptamine
small-molecule
Yes
No
Tan Y, Xu P, Huang S, Yang G, Zhou F, He X, Ma H, Xu HE, Jiang Y
10.1038/S41421-022-00412-3
2022-09-14
Yes
T2R46
TAS2R46
Taste 2
T
Human
cryo-EM
7XP5
-
3.1
R
Active
-
97
Gi/o
αt3
-
42
-
Nanobody-35
Apo (no ligand)
none
Apo (no ligand)
-
-
No
No
Xu W, Wu L, Liu S, Liu X, Cao X, Zhou C, Zhang J, Fu Y, Guo Y, Wu Y, Tan Q, Wang L, Liu J, Jiang L, Fan Z, Pei Y, Yu J, Cheng J, Zhao S, Hao X, Liu ZJ, Hua T
10.1126/SCIENCE.ABO1633
2022-10-12
Yes
T2R46
TAS2R46
Taste 2
T
Human
cryo-EM
7XP6
-
3.0
R
Active
-
92
Gi/o
αt3
-
42
-
Nanobody-35
strychnine
small-molecule
Agonist
-
-
No
No
Xu W, Wu L, Liu S, Liu X, Cao X, Zhou C, Zhang J, Fu Y, Guo Y, Wu Y, Tan Q, Wang L, Liu J, Jiang L, Fan Z, Pei Y, Yu J, Cheng J, Zhao S, Hao X, Liu ZJ, Hua T
10.1126/SCIENCE.ABO1633
2022-10-12
Yes
OX2R
OX2
Orexin
A
Human
X-ray
7XRR
7XRR_refined
2.9
A
Inactive
1
70
-
-
-
-
-
-
lemborexant
small-molecule
Antagonist
orexin-A, orexin-B
peptide
No
No
Asada H, Im D, Hotta Y, Yasuda S, Murata T, Suno R, Iwata S
10.1016/J.STR.2022.11.001
2022-11-23
Yes
TRFR
TRH1
Thyrotropin-releasing hormone
A
Human
cryo-EM
7XW9
7XW9_refined
2.7
R
Active
100
72
Gq/11
αq
-
63
-
scFv16
TRH
peptide
Agonist
TRH
peptide
Yes
No
-
-
2022-12-28
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7Y24
7Y24_refined
3.3
E
Active
100
77
Gi/o
αo
-
60
-
scFv16
Octreotide
peptide
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Chen S, Teng X, Zheng S
10.1038/S41589-022-01130-3
2022-10-19
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7Y26
-
3.3
E
Active
100
73
Gq/11
αq
Mini-Gq
62
-
scFv16
Octreotide
peptide
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Chen S, Teng X, Zheng S
10.1038/S41589-022-01130-3
2022-10-19
Yes
SSR2
SST2
Somatostatin
A
Human
cryo-EM
7Y27
-
3.5
E
Active
100
74
Gq/11
αq
Mini-Gq
64
-
scFv16
SOMATOSTATIN
protein
Agonist
CST-17, cortistatin-14, SRIF-28, SRIF-14
peptide
Yes
No
Chen S, Teng X, Zheng S
10.1038/S41589-022-01130-3
2022-10-19
Yes
GPR17
GPR17
A orphans
A
Human
cryo-EM
7Y89
7Y89_refined
3.0
A
Active
100
78
Gi/o
αi1
-
58
-
-
Apo (no ligand)
none
Apo (no ligand)
LTD4 , LTE4 , uridine diphosphate, ATP, LTC4 , UDP-glucose, UDP-galactose
small-molecule
Yes
No
Ye F, Wong TS, Chen G, Zhang Z, Zhang B, Gan S, Gao W, Li J, Wu Z, Pan X, Du Y
10.1002/MCO2.159
2022-10-12
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU3
7YU3_refined
3.4
R
Active
100
80
Gi/o
αi1
-
63
-
scFv16
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU4
7YU4_refined
3.3
A
Active
99
73
-
-
-
-
-
-
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU5
7YU5_refined
3.3
R
Active
100
80
Gi/o
αi1
-
63
-
scFv16
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU6
7YU6_refined
3.5
R
Active
100
80
Gi/o
αi1
-
63
-
scFv16
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU7
7YU7_refined
3.8
R
Active
100
80
Gi/o
αi1
-
63
-
scFv16
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
LPAR1
LPA1
Lysophospholipid (LPA)
A
Human
cryo-EM
7YU8
7YU8_refined
4.5
R
Active
100
80
Gi/o
αi1
-
63
-
scFv16
[(2~{R})-2-[5-(2-hexylphenyl)pentanoylamino]-3-oxidanyl-propyl] dihydrogen phosphate
small-molecule
Agonist
1-O-Oleoyl-D-glycerol 3-phosphoric acid
small-molecule
Yes
No
Akasaka H, Tanaka T, Sano FK, Matsuzaki Y, Shihoya W, Nureki O
10.1038/S41467-022-33121-2
2022-10-05
Yes
MRGX1
MRGPRX1
A orphans
A
Human
cryo-EM
8DWC
-
2.9
R
Active
100
78
Gs
αs
Gs-mini-Gq chimera
56
-
scFv16
Proenkephalin-A
peptide
Agonist
bovine adrenal medulla peptide 8-22
peptide
No
No
Liu Y, Cao C, Huang XP, Gumpper RH, Rachman MM, Shih SL, Krumm BE, Zhang S, Shoichet BK, Fay JF, Roth BL
10.1038/S41589-022-01173-6
2022-11-02
Yes
MRGX1
MRGPRX1
A orphans
A
Human
cryo-EM
8DWG
-
2.7
R
Active
100
77
Gs
αs
Gs-mini-Gq chimera
56
-
scFv16
Proenkephalin-A
2-(Cyclopropanesulfonamido)-N-(2-ethoxyphenyl)benzamide
peptide small-molecule
Agonist PAM
bovine adrenal medulla peptide 8-22
peptide
No
No
Liu Y, Cao C, Huang XP, Gumpper RH, Rachman MM, Shih SL, Krumm BE, Zhang S, Shoichet BK, Fay JF, Roth BL
10.1038/S41589-022-01173-6
2022-11-02
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
8HAF
-
3.3
R
Active
100
62
Gs
αs
-
56
-
Nanobody-35
PTHrP-(1-36)
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Yuan QN, Dai AT, He XH, Chen CW, Zhang C, Xu YW, Zhou Y, Wang MW, Yang DH, Xu HE
10.1038/S41401-022-01032-Z
2022-12-21
Yes
MRGX1
MRGPRX1
A orphans
A
Human
cryo-EM
8DWH
-
3.3
R
Active
100
77
Gs
αs
Gs-mini-Gq chimera
56
-
-
compound 16 [PMID: 31498617]
small-molecule
Agonist
bovine adrenal medulla peptide 8-22
peptide
No
No
Liu Y, Cao C, Huang XP, Gumpper RH, Rachman MM, Shih SL, Krumm BE, Zhang S, Shoichet BK, Fay JF, Roth BL
10.1038/S41589-022-01173-6
2022-11-02
Yes
OPRX
NOP
Opioid
A
Human
cryo-EM
8F7X
8F7X_refined
3.3
R
Active
100
77
Gi/o
αi1
-
62
-
scFv16
nociceptin/orphanin FQ
peptide
Agonist
nociceptin/orphanin FQ
peptide
Yes
No
Wang Y, Zhuang Y, DiBerto JF, Zhou XE, Schmitz GP, Yuan Q, Jain MK, Liu W, Melcher K, Jiang Y, Roth BL, Xu HE
10.1016/J.CELL.2022.12.026
2022-12-14
Yes
PACR
PAC1
VIP and PACAP
B1
Human
cryo-EM
8E3X
8E3X_refined
2.3
R
Active
100
77
Gs
αs
-
59
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, PHI, PACAP-38, VIP, PHV
peptide
No
No
Piper SJ, Deganutti G, Lu J, Zhao P, Liang YL, Lu Y, Fletcher MM, Hossain MA, Christopoulos A, Reynolds CA, Danev R, Sexton PM, Wootten D
10.1038/S41467-022-34629-3
2022-11-23
Yes
VIPR1
VPAC1
VIP and PACAP
B1
Human
cryo-EM
8E3Y
-
2.3
R
Active
100
81
Gs
αs
-
56
-
Nanobody-35
[Ac-His1 ]PACAP-27
peptide
Agonist
PACAP-27, PHM, secretin, GHRH, PACAP-38, VIP, PHI
peptide
No
No
Piper SJ, Deganutti G, Lu J, Zhao P, Liang YL, Lu Y, Fletcher MM, Hossain MA, Christopoulos A, Reynolds CA, Danev R, Sexton PM, Wootten D
10.1038/S41467-022-34629-3
2022-11-23
Yes
VIPR1
VPAC1
VIP and PACAP
B1
Human
cryo-EM
8E3Z
8E3Z_refined
2.7
R
Active
100
81
Gs
αs
-
55
-
Nanobody-35
Vasoactive intestinal polypeptide
small-molecule
Agonist
PACAP-27, PHM, secretin, GHRH, PACAP-38, VIP, PHI
peptide
No
No
Piper SJ, Deganutti G, Lu J, Zhao P, Liang YL, Lu Y, Fletcher MM, Hossain MA, Christopoulos A, Reynolds CA, Danev R, Sexton PM, Wootten D
10.1038/S41467-022-34629-3
2022-11-23
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Human
cryo-EM
8E9W
-
2.7
A
Active
100
47
Gq/11
αq
mini-Gq
59
-
scFv16
CHEMBL73538
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Zhang S, Gumpper RH, Huang XP, Liu Y, Krumm BE, Cao C, Fay JF, Roth BL
10.1038/S41586-022-05489-0
2022-11-30
Yes
ACM4
M4
Acetylcholine (muscarinic)
A
Human
cryo-EM
8E9X
-
2.7
A
Active
100
57
Gi/o
αo
mini-Go
58
-
scFv16
CHEMBL73538
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Zhang S, Gumpper RH, Huang XP, Liu Y, Krumm BE, Cao C, Fay JF, Roth BL
10.1038/S41586-022-05489-0
2022-11-30
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Human
cryo-EM
8E9Y
-
2.8
A
Active
100
47
Gq/11
αq
mini-Gq
61
-
scFv16
Clozapine N-oxide
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Zhang S, Gumpper RH, Huang XP, Liu Y, Krumm BE, Cao C, Fay JF, Roth BL
10.1038/S41586-022-05489-0
2022-11-30
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Human
cryo-EM
8E9Z
-
2.7
A
Active
100
47
Gq/11
αq
mini-Gq
62
-
scFv16
iperoxo
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Zhang S, Gumpper RH, Huang XP, Liu Y, Krumm BE, Cao C, Fay JF, Roth BL
10.1038/S41586-022-05489-0
2022-11-30
Yes
ACM3
M3
Acetylcholine (muscarinic)
A
Human
cryo-EM
8EA0
8EA0_refined
2.6
A
Active
99
48
-
-
-
-
-
-
iperoxo
small-molecule
Agonist
acetylcholine
small-molecule
Yes
No
Zhang S, Gumpper RH, Huang XP, Liu Y, Krumm BE, Cao C, Fay JF, Roth BL
10.1038/S41586-022-05489-0
2022-11-30
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EF5
-
3.3
R
Active
100
72
Gi/o
αi1
-
64
-
scFv16
fentanyl
small-molecule
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EF6
8EF6_refined
3.2
R
Active
100
72
Gi/o
αi1
-
64
-
scFv16
morphine
small-molecule
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EFB
8EFB_refined
3.2
R
Active
100
71
Gi/o
αi1
-
64
-
scFv16
OLICERIDINE
small-molecule
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EFL
8EFL_refined
3.2
R
Active
100
72
Gi/o
αi1
-
64
-
scFv16
CHEMBL4452384
small-molecule
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EFO
8EFO_refined
2.8
R
Active
100
72
Gi/o
αi1
-
64
-
scFv16
PZM21
small-molecule
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8EFQ
-
3.3
R
Active
100
71
Gi/o
αi1
-
61
-
-
DAMGO
peptide
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Zhuang Y, Wang Y, He B, He X, Zhou XE, Guo S, Rao Q, Yang J, Liu J, Zhou Q, Wang X, Liu M, Liu W, Jiang X, Yang D, Jiang H, Shen J, Melcher K, Chen H, Jiang Y, Cheng X, Wang MW, Xie X, Xu HE
10.1016/J.CELL.2022.09.041
2022-11-09
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8F7Q
-
3.2
R
Active
100
72
Gi/o
αi1
-
64
-
scFv16
β-endorphin
peptide
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Wang Y, Zhuang Y, DiBerto JF, Zhou XE, Schmitz GP, Yuan Q, Jain MK, Liu W, Melcher K, Jiang Y, Roth BL, Xu HE
10.1016/J.CELL.2022.12.026
2022-12-14
Yes
OPRM
μ
Opioid
A
Human
cryo-EM
8F7R
8F7R_refined
3.3
R
Active
100
72
Gi/o
αi1
-
63
-
scFv16
endomorphin-1
peptide
Agonist
endomorphin-1, endomorphin-2, dynorphin A, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Wang Y, Zhuang Y, DiBerto JF, Zhou XE, Schmitz GP, Yuan Q, Jain MK, Liu W, Melcher K, Jiang Y, Roth BL, Xu HE
10.1016/J.CELL.2022.12.026
2022-12-14
Yes
OPRD
δ
Opioid
A
Human
cryo-EM
8F7S
8F7S_refined
3.0
R
Active
100
78
Gi/o
αi1
-
62
-
-
DELTORPHIN II
protein
Agonist
endomorphin-1, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
No
No
Wang Y, Zhuang Y, DiBerto JF, Zhou XE, Schmitz GP, Yuan Q, Jain MK, Liu W, Melcher K, Jiang Y, Roth BL, Xu HE
10.1016/J.CELL.2022.12.026
2022-12-14
Yes
OPRK
κ
Opioid
A
Human
cryo-EM
8F7W
8F7W_refined
3.2
R
Active
100
75
Gi/o
αi1
-
64
-
scFv16
dynorphin A-(1-8)
peptide
Agonist
big dynorphin, β-neoendorphin, dynorphin A, α-neoendorphin, [Leu]enkephalin, dynorphin A-(1-13), dynorphin A-(1-8), [Met]enkephalin, dynorphin B, β-endorphin
peptide
Yes
No
Wang Y, Zhuang Y, DiBerto JF, Zhou XE, Schmitz GP, Yuan Q, Jain MK, Liu W, Melcher K, Jiang Y, Roth BL, Xu HE
10.1016/J.CELL.2022.12.026
2022-12-14
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
8HA0
-
2.6
R
Active
100
61
Gs
αs
-
56
-
Nanobody-35
teriparatide
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Yuan QN, Dai AT, He XH, Chen CW, Zhang C, Xu YW, Zhou Y, Wang MW, Yang DH, Xu HE
10.1038/S41401-022-01032-Z
2022-12-21
Yes
PTH1R
PTH1
Parathyroid hormone
B1
Human
cryo-EM
8HAO
-
3.8
R
Active
100
61
Gs
αs
-
56
-
Nanobody-35
teriparatide
peptide
Agonist
TIP39, PTHrP, PTH, PTHrP-(1-36)
peptide
No
No
Zhao LH, Yuan QN, Dai AT, He XH, Chen CW, Zhang C, Xu YW, Zhou Y, Wang MW, Yang DH, Xu HE
10.1038/S41401-022-01032-Z
2022-12-21
Yes